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Phenoxyacetic acid derivatives

Organic compounds that are directly derived from phenoxyacetic acid; phenoxyacetic acid consists of a phenoxy group with a carboxylic acid group.

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2

Efaproxiral, TRC

CAS: 131179-95-8 Molecular Formula: C20 H23 N O4 Molecular Weight (g/mol): 341.4 Synonym: Propanoic acid, 2-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxoethyl]phenoxy]-2-methyl-,2-[4-[2-[(3,5-Dimethylphenyl)amino]-2-oxoethyl]phenoxy]-2-methylpropanoic acid,2-[4-[(3,5-Dimethylanilino carbonyl)methyl]phenoxy]-2-methylpropionic acid,2-[4-[[[(3,5-Dimethylphenyl)amino]carbonyl]methyl]phenoxy]-2-methylpropionic acid,Efaproxiral,RSR 13 IUPAC Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]-2-methylpropanoic acid SMILES: Cc1cc(C)cc(NC(=O)Cc2ccc(OC(C)(C)C(=O)O)cc2)c1

CAS 131179-95-8
Molecular Weight (g/mol) 341.4
SMILES Cc1cc(C)cc(NC(=O)Cc2ccc(OC(C)(C)C(=O)O)cc2)c1
Synonym Propanoic acid, 2-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxoethyl]phenoxy]-2-methyl-,2-[4-[2-[(3,5-Dimethylphenyl)amino]-2-oxoethyl]phenoxy]-2-methylpropanoic acid,2-[4-[(3,5-Dimethylanilino carbonyl)methyl]phenoxy]-2-methylpropionic acid,2-[4-[[[(3,5-Dimethylphenyl)amino]carbonyl]methyl]phenoxy]-2-methylpropionic acid,Efaproxiral,RSR 13
IUPAC Name 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]-2-methylpropanoic acid
Molecular Formula C20 H23 N O4
3

2-(5-formyl-2-methoxyphenoxy)acetic Acid, TRC

CAS: 19728-22-4 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.18 SMILES: COc1ccc(C=O)cc1OCC(=O)O

CAS 19728-22-4
Molecular Weight (g/mol) 210.18
SMILES COc1ccc(C=O)cc1OCC(=O)O
Molecular Formula C10H10O5
4

2-(2-formyl-4-methoxyphenoxy)acetic Acid, TRC

CAS: 24589-93-3 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.18 SMILES: COc1ccc(OCC(=O)O)c(C=O)c1

CAS 24589-93-3
Molecular Weight (g/mol) 210.18
SMILES COc1ccc(OCC(=O)O)c(C=O)c1
Molecular Formula C10H10O5
5

2-(1,3-Dioxo-3,4-dihydroisoquinolin-2(1H)-yl)acetic Acid, TRC

CAS: 52208-61-4 Molecular Formula: C11H9NO4 Molecular Weight (g/mol): 219.19 Synonym: 2-(1,3-Dioxo-1,2,3,4-tetrahydroisoquinolin-2-yl)acetic acid SMILES: OC(=O)CN1C(=O)Cc2ccccc2C1=O

CAS 52208-61-4
Molecular Weight (g/mol) 219.19
SMILES OC(=O)CN1C(=O)Cc2ccccc2C1=O
Synonym 2-(1,3-Dioxo-1,2,3,4-tetrahydroisoquinolin-2-yl)acetic acid
Molecular Formula C11H9NO4
6

[4-(1,1,3,3-Tetramethylbutyl)phenoxy]acetic acid, TRC

CAS: 13402-97-6 Molecular Formula: C16 H24 O3 Molecular Weight (g/mol): 264.36 IUPAC Name: 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetic acid SMILES: CC(C)(C)CC(C)(C)c1ccc(OCC(=O)O)cc1

CAS 13402-97-6
Molecular Weight (g/mol) 264.36
SMILES CC(C)(C)CC(C)(C)c1ccc(OCC(=O)O)cc1
IUPAC Name 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetic acid
Molecular Formula C16 H24 O3
7

Zinquin Ethyl Ester, TRC

CAS: 181530-09-6 Molecular Formula: C21 H22 N2 O5 S Molecular Weight (g/mol): 414.47 Synonym: 2-[[2-Methyl-8-[[(4-methylphenyl)sulfonyl]amino]-6-quinolinyl]oxy]acetic Acid,Zinquin Zinquin A,[[2-Methyl-8-[[(4-methylphenyl)sulfonyl]amino]-6-quinolinyl]oxy]-acetic Acid IUPAC Name: ethyl 2-[2-methyl-8-[(4-methylphenyl)sulfonylamino]quinolin-6-yl]oxyacetate SMILES: CCOC(=O)COc1cc(NS(=O)(=O)c2ccc(C)cc2)c3nc(C)ccc3c1

CAS 181530-09-6
Molecular Weight (g/mol) 414.47
SMILES CCOC(=O)COc1cc(NS(=O)(=O)c2ccc(C)cc2)c3nc(C)ccc3c1
Synonym 2-[[2-Methyl-8-[[(4-methylphenyl)sulfonyl]amino]-6-quinolinyl]oxy]acetic Acid,Zinquin Zinquin A,[[2-Methyl-8-[[(4-methylphenyl)sulfonyl]amino]-6-quinolinyl]oxy]-acetic Acid
IUPAC Name ethyl 2-[2-methyl-8-[(4-methylphenyl)sulfonylamino]quinolin-6-yl]oxyacetate
Molecular Formula C21 H22 N2 O5 S
8

Bezafibrate Ethyl Ester, TRC

CAS: 41859-58-9 Molecular Formula: C21 H24 Cl N O4 Molecular Weight (g/mol): 389.87 Synonym: Ethyl 2-[4-[2-[(4-Chloro-benzoyl)amino]ethyl]phenoxy]-2-methylpropanoate,Bezafibrate Imp. D (EP) IUPAC Name: ethyl 2-[4-[2-[(4-chlorobenzoyl)amino]ethyl]phenoxy]-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1

CAS 41859-58-9
Molecular Weight (g/mol) 389.87
SMILES CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1
Synonym Ethyl 2-[4-[2-[(4-Chloro-benzoyl)amino]ethyl]phenoxy]-2-methylpropanoate,Bezafibrate Imp. D (EP)
IUPAC Name ethyl 2-[4-[2-[(4-chlorobenzoyl)amino]ethyl]phenoxy]-2-methylpropanoate
Molecular Formula C21 H24 Cl N O4
9

Flufenpyr, TRC

CAS: 188490-07-5 Molecular Formula: C14 H9 Cl F4 N2 O4 Molecular Weight (g/mol): 380.68 Synonym: Acetic acid, [2-chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)-1(6H)-pyridazinyl]phenoxy]- (9CI),2-[2-Chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)-1(6H)-pyridazinyl]phenoxy]acetic acid,Flufenpyr IUPAC Name: 2-[2-chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)pyridazin-1-yl]phenoxy]acetic acid SMILES: CC1=C(C=NN(C1=O)c2cc(OCC(=O)O)c(Cl)cc2F)C(F)(F)F

CAS 188490-07-5
Molecular Weight (g/mol) 380.68
SMILES CC1=C(C=NN(C1=O)c2cc(OCC(=O)O)c(Cl)cc2F)C(F)(F)F
Synonym Acetic acid, [2-chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)-1(6H)-pyridazinyl]phenoxy]- (9CI),2-[2-Chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)-1(6H)-pyridazinyl]phenoxy]acetic acid,Flufenpyr
IUPAC Name 2-[2-chloro-4-fluoro-5-[5-methyl-6-oxo-4-(trifluoromethyl)pyridazin-1-yl]phenoxy]acetic acid
Molecular Formula C14 H9 Cl F4 N2 O4
10

Ethacrynic Acid-d5, TRC

CAS: 1330052-59-9 Molecular Formula: C13H7D5Cl2O4 Molecular Weight (g/mol): 308.17 Synonym: 2-[2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy-d5]acetic Acid,[4-(2-Methylenebutyryl)-2,3-dichlorophenoxy-d5]acetic Acid,Crinuril-d5,Edecril-d5,Edecrin-d5,Edecrina-d5,Endecril-d5,Etacrynic Acid-d5,Etakrinic Acid-d5,Hidromedin-d5,Hydromedin-d5,MK 595-d5,Mingit-d5,NSC 624008-d5,NSC 85791-d5,Otacril-d5,Reomax-d5,Taladren-d5,Uregit-d5; SMILES: ClC1=C(Cl)C(OCC(O)=O)=CC=C1C(C(C([2H])([2H])C([2H])([2H])[2H])=C)=O

CAS 1330052-59-9
Molecular Weight (g/mol) 308.17
SMILES ClC1=C(Cl)C(OCC(O)=O)=CC=C1C(C(C([2H])([2H])C([2H])([2H])[2H])=C)=O
Synonym 2-[2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy-d5]acetic Acid,[4-(2-Methylenebutyryl)-2,3-dichlorophenoxy-d5]acetic Acid,Crinuril-d5,Edecril-d5,Edecrin-d5,Edecrina-d5,Endecril-d5,Etacrynic Acid-d5,Etakrinic Acid-d5,Hidromedin-d5,Hydromedin-d5,MK 595-d5,Mingit-d5,NSC 624008-d5,NSC 85791-d5,Otacril-d5,Reomax-d5,Taladren-d5,Uregit-d5;
Molecular Formula C13H7D5Cl2O4
11

GW 501516 Sulfone, TRC

CAS: 1206891-27-1 Molecular Formula: C21H18F3NO5S2 Molecular Weight (g/mol): 485.5 Synonym: 2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]sulfonyl]phenoxy]-acetic Acid IUPAC Name: 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfonyl]phenoxy]acetic acid SMILES: O=[S](CC(SC(C1=CC=C(C(F)(F)F)C=C1)=N2)=C2C)(C3=CC(C)=C(OCC(O)=O)C=C3)=O

CAS 1206891-27-1
Molecular Weight (g/mol) 485.5
SMILES O=[S](CC(SC(C1=CC=C(C(F)(F)F)C=C1)=N2)=C2C)(C3=CC(C)=C(OCC(O)=O)C=C3)=O
Synonym 2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]sulfonyl]phenoxy]-acetic Acid
IUPAC Name 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfonyl]phenoxy]acetic acid
Molecular Formula C21H18F3NO5S2
12

Meclofenoxate Hydrochloride, TRC

CAS: 3685-84-5 Molecular Formula: C12 H16 Cl N O3 . Cl H Molecular Weight (g/mol): 294.17 Synonym: Acetic acid, 2-(4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (1:1),Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (9CI),Acetic acid, (p-chlorophenoxy)-, 2-(dimethylamino)ethyl ester hydrochloride (6CI,8CI),2-(Dimethylamino)ethyl (p-chlorophenoxy)acetate hydrochloride,Acefen,Acephen,Brenal,Cellative,Centrophenoxine,Centrophenoxine hydrochloride,Cerutil,Dimethylaminoethyl 4-chlorophenoxyacetate hydrochloride,Dimethylaminoethyl p-chlorophenoxyacetate hydrochloride,Helfergin,Lucidril,Lucidryl hydrochloride,Marucotol,Meclofenoxate hydrochloride,Meclophenoxate hydrochloride,Methocynal,Proserout IUPAC Name: 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate;hydrochloride SMILES: Cl.CN(C)CCOC(=O)COc1ccc(Cl)cc1

CAS 3685-84-5
Molecular Weight (g/mol) 294.17
SMILES Cl.CN(C)CCOC(=O)COc1ccc(Cl)cc1
Synonym Acetic acid, 2-(4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (1:1),Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (9CI),Acetic acid, (p-chlorophenoxy)-, 2-(dimethylamino)ethyl ester hydrochloride (6CI,8CI),2-(Dimethylamino)ethyl (p-chlorophenoxy)acetate hydrochloride,Acefen,Acephen,Brenal,Cellative,Centrophenoxine,Centrophenoxine hydrochloride,Cerutil,Dimethylaminoethyl 4-chlorophenoxyacetate hydrochloride,Dimethylaminoethyl p-chlorophenoxyacetate hydrochloride,Helfergin,Lucidril,Lucidryl hydrochloride,Marucotol,Meclofenoxate hydrochloride,Meclophenoxate hydrochloride,Methocynal,Proserout
IUPAC Name 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate;hydrochloride
Molecular Formula C12 H16 Cl N O3 . Cl H
13

GW 501516 Sulfoxide, TRC

CAS: 1206891-26-0 Molecular Formula: C21H18F3NO4S2 Molecular Weight (g/mol): 469.5 Synonym: 2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]sulfinyl]phenoxy]acetic Acid,2-(2-Methyl-4-(((4-methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)methyl)sulfinyl)phenoxy)acetic Acid IUPAC Name: 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfinyl]phenoxy]acetic acid SMILES: O=S(CC1=C(C)N=C(C2=CC=C(C(F)(F)F)C=C2)S1)C3=CC=C(OCC(O)=O)C(C)=C3

CAS 1206891-26-0
Molecular Weight (g/mol) 469.5
SMILES O=S(CC1=C(C)N=C(C2=CC=C(C(F)(F)F)C=C2)S1)C3=CC=C(OCC(O)=O)C(C)=C3
Synonym 2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]sulfinyl]phenoxy]acetic Acid,2-(2-Methyl-4-(((4-methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)methyl)sulfinyl)phenoxy)acetic Acid
IUPAC Name 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfinyl]phenoxy]acetic acid
Molecular Formula C21H18F3NO4S2
14

Alpha,Alpha-Bis[4-(dimethylamino)phenyl]-4-(phenylamino)-1-naphthalenemethanol (Technical Grade), TRC

CAS: 6786-83-0 Molecular Formula: C33 H33 N3 O Molecular Weight (g/mol): 487.63 Synonym: C.I. Solvent Blue 4,Aizen Victoria Blue B Base,Baso Blue 645,Brilliant Oil Blue B Base,C.I. 44045B,Fast Oil Blue B Base,Solvent Blue 4,Victoria Blue B Base,Victoria Blue BA Base,Victoria Blue BDP Base,Victoria Blue Base,Victoria Blue Base B,Victoria Blue Base FB,Waxoline Victoria Blue B IUPAC Name: (4-anilino-1-naphthyl)-bis[4-(dimethylamino)phenyl]methanol SMILES: CN(C)c1ccc(cc1)C(O)(c2ccc(cc2)N(C)C)c3ccc(Nc4ccccc4)c5ccccc35

CAS 6786-83-0
Molecular Weight (g/mol) 487.63
SMILES CN(C)c1ccc(cc1)C(O)(c2ccc(cc2)N(C)C)c3ccc(Nc4ccccc4)c5ccccc35
Synonym C.I. Solvent Blue 4,Aizen Victoria Blue B Base,Baso Blue 645,Brilliant Oil Blue B Base,C.I. 44045B,Fast Oil Blue B Base,Solvent Blue 4,Victoria Blue B Base,Victoria Blue BA Base,Victoria Blue BDP Base,Victoria Blue Base,Victoria Blue Base B,Victoria Blue Base FB,Waxoline Victoria Blue B
IUPAC Name (4-anilino-1-naphthyl)-bis[4-(dimethylamino)phenyl]methanol
Molecular Formula C33 H33 N3 O
15

GW0742, TRC

CAS: 317318-84-6 Molecular Formula: C21 H17 F4 N O3 S2 Molecular Weight (g/mol): 471.49 Synonym: Acetic acid, 2-[4-[[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]-,Acetic acid, [4-[[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]- (9CI),2-[4-[[[2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]acetic acid,GW 0742,GW 0742X,GW 610742,GWδ 0742 IUPAC Name: 2-[4-[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl]methylsulfanyl]-2-methylphenoxy]acetic acid SMILES: Cc1cc(SCc2sc(nc2C)c3ccc(c(F)c3)C(F)(F)F)ccc1OCC(=O)O

CAS 317318-84-6
Molecular Weight (g/mol) 471.49
SMILES Cc1cc(SCc2sc(nc2C)c3ccc(c(F)c3)C(F)(F)F)ccc1OCC(=O)O
Synonym Acetic acid, 2-[4-[[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]-,Acetic acid, [4-[[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]- (9CI),2-[4-[[[2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-thiazolyl]methyl]thio]-2-methylphenoxy]acetic acid,GW 0742,GW 0742X,GW 610742,GWδ 0742
IUPAC Name 2-[4-[[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl]methylsulfanyl]-2-methylphenoxy]acetic acid
Molecular Formula C21 H17 F4 N O3 S2