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Aminobenzoic acids and derivatives

Organic compounds that consist of a benzene ring substituted with amino and carboxyl groups. Includes compounds that are derived from aminobenzoic acids.
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1 – 15 of 45 results
1

4-Aminobenzoic acid, 99%

CAS: 150-13-0 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007894 InChI Key: ALYNCZNDIQEVRV-UHFFFAOYSA-N Synonym: p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino PubChem CID: 978 ChEBI: CHEBI:30753 IUPAC Name: 4-aminobenzoic acid SMILES: NC1=CC=C(C=C1)C(O)=O

EDGE
PubChem CID 978
CAS 150-13-0
Molecular Weight (g/mol) 137.14
ChEBI CHEBI:30753
MDL Number MFCD00007894
SMILES NC1=CC=C(C=C1)C(O)=O
Synonym p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino
IUPAC Name 4-aminobenzoic acid
InChI Key ALYNCZNDIQEVRV-UHFFFAOYSA-N
Molecular Formula C7H7NO2
2

4-(4-Methylperhydro-1,4-diazepin-1-yl)benzoic acid hydrochloride hydrate, 95%, Thermo Scientific™

CAS: 303134-03-4 Molecular Formula: C13H19ClN2O2 Molecular Weight (g/mol): 270.757 MDL Number: MFCD09064999 InChI Key: KJZVHMAKWMCIBB-UHFFFAOYSA-N Synonym: 4-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,4-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1 PubChem CID: 24229616 IUPAC Name: 4-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride SMILES: CN1CCCN(CC1)C2=CC=C(C=C2)C(=O)O.Cl

PubChem CID 24229616
CAS 303134-03-4
Molecular Weight (g/mol) 270.757
MDL Number MFCD09064999
SMILES CN1CCCN(CC1)C2=CC=C(C=C2)C(=O)O.Cl
Synonym 4-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,4-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1
IUPAC Name 4-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride
InChI Key KJZVHMAKWMCIBB-UHFFFAOYSA-N
Molecular Formula C13H19ClN2O2
3

2-(4-Methylpiperazin-1-yl)benzoic acid, ≥97%, Thermo Scientific™

CAS: 159589-70-5 Molecular Formula: C12H16N2O2 Molecular Weight (g/mol): 220.27 MDL Number: MFCD01788118 InChI Key: WKGFDTBUUBBWJZ-UHFFFAOYSA-N Synonym: 2-4-methylpiperazin-1-yl benzoic acid,2-4-methyl-piperazin-1-yl-benzoic acid,2-4-methyl-1-piperazinyl benzoic acid,1-2-carboxyphenyl-4-methylpiperazine,2-4-methylpiperazinyl benzoic acid,4-methyl-piperazin-1-yl-benzoic acid,2-4-methylpiperazin-1-yl benzoicacid,benzoic acid,2-4-methyl-1-piperazinyl,benzoic acid, 2-4-methyl-1-piperazinyl PubChem CID: 1120459 IUPAC Name: 2-(4-methylpiperazin-1-yl)benzoic acid SMILES: CN1CCN(CC1)C1=CC=CC=C1C(O)=O

PubChem CID 1120459
CAS 159589-70-5
Molecular Weight (g/mol) 220.27
MDL Number MFCD01788118
SMILES CN1CCN(CC1)C1=CC=CC=C1C(O)=O
Synonym 2-4-methylpiperazin-1-yl benzoic acid,2-4-methyl-piperazin-1-yl-benzoic acid,2-4-methyl-1-piperazinyl benzoic acid,1-2-carboxyphenyl-4-methylpiperazine,2-4-methylpiperazinyl benzoic acid,4-methyl-piperazin-1-yl-benzoic acid,2-4-methylpiperazin-1-yl benzoicacid,benzoic acid,2-4-methyl-1-piperazinyl,benzoic acid, 2-4-methyl-1-piperazinyl
IUPAC Name 2-(4-methylpiperazin-1-yl)benzoic acid
InChI Key WKGFDTBUUBBWJZ-UHFFFAOYSA-N
Molecular Formula C12H16N2O2
4

2,3-Diaminobenzoic acid, 95%

CAS: 603-81-6 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00137818 InChI Key: KKTUQAYCCLMNOA-UHFFFAOYSA-N Synonym: diaminobenzoic acid,benzoic acid, diamino,3-carboxy-1,2-diaminobenzene,pubchem3145,acmc-209mjn,2,3-diaminobenzonic acid,2,3-diamino benzoic acid,ksc203g4l,pharmabridge p-2952,2,3-diaminobenzoic acid PubChem CID: 198069 IUPAC Name: 2,3-diaminobenzoic acid SMILES: NC1=CC=CC(C(O)=O)=C1N

PubChem CID 198069
CAS 603-81-6
Molecular Weight (g/mol) 152.15
MDL Number MFCD00137818
SMILES NC1=CC=CC(C(O)=O)=C1N
Synonym diaminobenzoic acid,benzoic acid, diamino,3-carboxy-1,2-diaminobenzene,pubchem3145,acmc-209mjn,2,3-diaminobenzonic acid,2,3-diamino benzoic acid,ksc203g4l,pharmabridge p-2952,2,3-diaminobenzoic acid
IUPAC Name 2,3-diaminobenzoic acid
InChI Key KKTUQAYCCLMNOA-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
5

2-(4-Methylperhydro-1,4-diazepin-1-yl)benzoic acid hydrochloride hemihydrate, 95%, Thermo Scientific™

CAS: 921938-77-4 Molecular Formula: C13H19ClN2O2 Molecular Weight (g/mol): 270.757 MDL Number: MFCD09065004 InChI Key: UCYNEWGETFFMQY-UHFFFAOYSA-N Synonym: 2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1 PubChem CID: 24229621 IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride SMILES: CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl

PubChem CID 24229621
CAS 921938-77-4
Molecular Weight (g/mol) 270.757
MDL Number MFCD09065004
SMILES CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl
Synonym 2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1
IUPAC Name 2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride
InChI Key UCYNEWGETFFMQY-UHFFFAOYSA-N
Molecular Formula C13H19ClN2O2
6

4-(4-Methylpiperazino)benzoic acid, 97%, Thermo Scientific™

CAS: 86620-62-4 Molecular Formula: C12H16N2O2 Molecular Weight (g/mol): 220.272 MDL Number: MFCD02682063 InChI Key: UCFZVQHKTRSZMM-UHFFFAOYSA-N Synonym: 4-4-methylpiperazin-1-yl benzoic acid,4-4-methylpiperazino benzoic acid,4-4-methyl-piperazin-1-yl-benzoic acid,4-4-methylpiperazinyl benzoic acid,4-4-methyl-piperazino benzoic acid,benzoic acid, 4-4-methyl-1-piperazinyl,4-4-methyl-1-piperazinyl benzoic acid,pubchem10481,ksc448o3p PubChem CID: 736532 IUPAC Name: 4-(4-methylpiperazin-1-yl)benzoic acid SMILES: CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

PubChem CID 736532
CAS 86620-62-4
Molecular Weight (g/mol) 220.272
MDL Number MFCD02682063
SMILES CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O
Synonym 4-4-methylpiperazin-1-yl benzoic acid,4-4-methylpiperazino benzoic acid,4-4-methyl-piperazin-1-yl-benzoic acid,4-4-methylpiperazinyl benzoic acid,4-4-methyl-piperazino benzoic acid,benzoic acid, 4-4-methyl-1-piperazinyl,4-4-methyl-1-piperazinyl benzoic acid,pubchem10481,ksc448o3p
IUPAC Name 4-(4-methylpiperazin-1-yl)benzoic acid
InChI Key UCFZVQHKTRSZMM-UHFFFAOYSA-N
Molecular Formula C12H16N2O2
7

2-Amino-3,5-dibromobenzoic acid, Thermo Scientific™

CAS: 609-85-8 Molecular Formula: C7H5Br2NO2 Molecular Weight (g/mol): 294.93 MDL Number: MFCD00017087 InChI Key: WNABMWFLKQEGCP-UHFFFAOYSA-N Synonym: 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128 PubChem CID: 219491 IUPAC Name: 2-amino-3,5-dibromobenzoic acid SMILES: NC1=C(Br)C=C(Br)C=C1C(O)=O

PubChem CID 219491
CAS 609-85-8
Molecular Weight (g/mol) 294.93
MDL Number MFCD00017087
SMILES NC1=C(Br)C=C(Br)C=C1C(O)=O
Synonym 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128
IUPAC Name 2-amino-3,5-dibromobenzoic acid
InChI Key WNABMWFLKQEGCP-UHFFFAOYSA-N
Molecular Formula C7H5Br2NO2
8

4-Aminobenzoic acid sodium salt, 98%

CAS: 555-06-6 Molecular Formula: C7H6NNaO2 Molecular Weight (g/mol): 159.12 MDL Number: MFCD00064395 InChI Key: XETSAYZRDCRPJY-UHFFFAOYSA-M Synonym: sodium 4-aminobenzoate,sodium p-aminobenzoate,4-aminobenzoic acid sodium salt,sodium aminobenzoate,aminobenzoate sodium,antergyl,pabavit,benzoic acid, 4-amino-, monosodium salt,monosodium 4-aminobenzoate,unii-75ui7quz5j PubChem CID: 517441 IUPAC Name: sodium;4-aminobenzoate SMILES: C1=CC(=CC=C1C(=O)[O-])N.[Na+]

PubChem CID 517441
CAS 555-06-6
Molecular Weight (g/mol) 159.12
MDL Number MFCD00064395
SMILES C1=CC(=CC=C1C(=O)[O-])N.[Na+]
Synonym sodium 4-aminobenzoate,sodium p-aminobenzoate,4-aminobenzoic acid sodium salt,sodium aminobenzoate,aminobenzoate sodium,antergyl,pabavit,benzoic acid, 4-amino-, monosodium salt,monosodium 4-aminobenzoate,unii-75ui7quz5j
IUPAC Name sodium;4-aminobenzoate
InChI Key XETSAYZRDCRPJY-UHFFFAOYSA-M
Molecular Formula C7H6NNaO2
9

2-Amino-5-fluorobenzoic acid, 97%

CAS: 446-08-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.13 MDL Number: MFCD00055566 InChI Key: FPQMGQZTBWIHDN-UHFFFAOYSA-N Synonym: 5-fluoroanthranilic acid,2-amino-5-fluoro-benzoic acid,benzoic acid, 2-amino-5-fluoro,5-faa,5-fluoro-2-aminobenzoic acid,4own,5rg,pubchem1322,5-fluoroanthanilic acid,acmc-209jyo PubChem CID: 101412 ChEBI: CHEBI:78042 IUPAC Name: 2-amino-5-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)N

PubChem CID 101412
CAS 446-08-2
Molecular Weight (g/mol) 155.13
ChEBI CHEBI:78042
MDL Number MFCD00055566
SMILES C1=CC(=C(C=C1F)C(=O)O)N
Synonym 5-fluoroanthranilic acid,2-amino-5-fluoro-benzoic acid,benzoic acid, 2-amino-5-fluoro,5-faa,5-fluoro-2-aminobenzoic acid,4own,5rg,pubchem1322,5-fluoroanthanilic acid,acmc-209jyo
IUPAC Name 2-amino-5-fluorobenzoic acid
InChI Key FPQMGQZTBWIHDN-UHFFFAOYSA-N
Molecular Formula C7H6FNO2
10

2-Amino-4-methylbenzoic acid, 95%, Thermo Scientific™

CAS: 2305-36-4 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00047853 InChI Key: RPGKFFKUTVJVPY-UHFFFAOYSA-N Synonym: 4-methylanthranilic acid,benzoic acid, 2-amino-4-methyl,2-amino-4-methyl-benzoic acid,2-amino-p-toluic acid,3-amino-4-carboxytoluene,2-carboxy-5-methylaniline,p-toluic acid, 2-amino,rarechem al bo 0820,benzoic acid, 2-amino-4-methyl-9ci,2-azanyl-4-methyl-benzoic acid PubChem CID: 75316 IUPAC Name: 2-amino-4-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)C(=O)O)N

PubChem CID 75316
CAS 2305-36-4
Molecular Weight (g/mol) 151.165
MDL Number MFCD00047853
SMILES CC1=CC(=C(C=C1)C(=O)O)N
Synonym 4-methylanthranilic acid,benzoic acid, 2-amino-4-methyl,2-amino-4-methyl-benzoic acid,2-amino-p-toluic acid,3-amino-4-carboxytoluene,2-carboxy-5-methylaniline,p-toluic acid, 2-amino,rarechem al bo 0820,benzoic acid, 2-amino-4-methyl-9ci,2-azanyl-4-methyl-benzoic acid
IUPAC Name 2-amino-4-methylbenzoic acid
InChI Key RPGKFFKUTVJVPY-UHFFFAOYSA-N
Molecular Formula C8H9NO2
11

3-Aminophthalic acid hydrochloride dihydrate, 96%

CAS: 1852533-96-0 Molecular Formula: C8H8ClNO4 Molecular Weight (g/mol): 217.605 MDL Number: MFCD00150282 InChI Key: ZBZAVEORKXFUQB-UHFFFAOYSA-N Synonym: 3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315 PubChem CID: 81375 IUPAC Name: 3-aminophthalic acid;hydrochloride SMILES: C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl

PubChem CID 81375
CAS 1852533-96-0
Molecular Weight (g/mol) 217.605
MDL Number MFCD00150282
SMILES C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl
Synonym 3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315
IUPAC Name 3-aminophthalic acid;hydrochloride
InChI Key ZBZAVEORKXFUQB-UHFFFAOYSA-N
Molecular Formula C8H8ClNO4
12

3-Dimethylaminobenzoic acid, 99%

CAS: 99-64-9 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00002497 InChI Key: NEGFNJRAUMCZMY-UHFFFAOYSA-N Synonym: 3-dimethylamino benzoic acid,benzoic acid, 3-dimethylamino,m-dimethylamino benzoic acid,m-dimethylaminobenzoic acid,n,n-dimethyl-m-aminobenzoic acid,3-dimethylamino-benzoic acid,3-n,n-dimethylaminobenzoic acid,benzoic acid, m-dimethylamino,m-dimethylamino-benzoic acid PubChem CID: 66837 IUPAC Name: 3-(dimethylamino)benzoic acid SMILES: CN(C)C1=CC=CC(=C1)C(=O)O

PubChem CID 66837
CAS 99-64-9
Molecular Weight (g/mol) 165.19
MDL Number MFCD00002497
SMILES CN(C)C1=CC=CC(=C1)C(=O)O
Synonym 3-dimethylamino benzoic acid,benzoic acid, 3-dimethylamino,m-dimethylamino benzoic acid,m-dimethylaminobenzoic acid,n,n-dimethyl-m-aminobenzoic acid,3-dimethylamino-benzoic acid,3-n,n-dimethylaminobenzoic acid,benzoic acid, m-dimethylamino,m-dimethylamino-benzoic acid
IUPAC Name 3-(dimethylamino)benzoic acid
InChI Key NEGFNJRAUMCZMY-UHFFFAOYSA-N
Molecular Formula C9H11NO2
13

3,5-Dibromoanthranilic acid, 98+%, Thermo Scientific™

CAS: 609-85-8 Molecular Formula: C7H5Br2NO2 Molecular Weight (g/mol): 294.93 MDL Number: MFCD00017087 InChI Key: WNABMWFLKQEGCP-UHFFFAOYSA-N Synonym: 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128 PubChem CID: 219491 IUPAC Name: 2-amino-3,5-dibromobenzoic acid SMILES: NC1=C(Br)C=C(Br)C=C1C(O)=O

PubChem CID 219491
CAS 609-85-8
Molecular Weight (g/mol) 294.93
MDL Number MFCD00017087
SMILES NC1=C(Br)C=C(Br)C=C1C(O)=O
Synonym 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128
IUPAC Name 2-amino-3,5-dibromobenzoic acid
InChI Key WNABMWFLKQEGCP-UHFFFAOYSA-N
Molecular Formula C7H5Br2NO2
14

3-Amino-4-chlorobenzoic acid, 98%, Thermo Scientific™

CAS: 2840-28-0 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007671 InChI Key: DMGFVJVLVZOSOE-UHFFFAOYSA-N Synonym: benzoic acid, 3-amino-4-chloro,unii-3q8r4430cf,3-amino-4-chloro benzoic acid,3-amino-4-chloro-benzoic acid,4-chloro-3-amino benzoic acid,pubchem8988,acmc-1cmgg,5-carboxy-2-chloroaniline,dsstox_cid_24414,dsstox_rid_80213 PubChem CID: 76092 IUPAC Name: 3-amino-4-chlorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)N)Cl

PubChem CID 76092
CAS 2840-28-0
Molecular Weight (g/mol) 171.58
MDL Number MFCD00007671
SMILES C1=CC(=C(C=C1C(=O)O)N)Cl
Synonym benzoic acid, 3-amino-4-chloro,unii-3q8r4430cf,3-amino-4-chloro benzoic acid,3-amino-4-chloro-benzoic acid,4-chloro-3-amino benzoic acid,pubchem8988,acmc-1cmgg,5-carboxy-2-chloroaniline,dsstox_cid_24414,dsstox_rid_80213
IUPAC Name 3-amino-4-chlorobenzoic acid
InChI Key DMGFVJVLVZOSOE-UHFFFAOYSA-N
Molecular Formula C7H6ClNO2
15

4-Aminobenzoic Acid, 99%

CAS: 150-13-0 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007894 InChI Key: ALYNCZNDIQEVRV-UHFFFAOYSA-N Synonym: p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino PubChem CID: 978 ChEBI: CHEBI:30753 IUPAC Name: 4-aminobenzoic acid SMILES: NC1=CC=C(C=C1)C(O)=O

PubChem CID 978
CAS 150-13-0
Molecular Weight (g/mol) 137.14
ChEBI CHEBI:30753
MDL Number MFCD00007894
SMILES NC1=CC=C(C=C1)C(O)=O
Synonym p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino
IUPAC Name 4-aminobenzoic acid
InChI Key ALYNCZNDIQEVRV-UHFFFAOYSA-N
Molecular Formula C7H7NO2