3-[[3-(2-carboxyethyl)phenyl]methoxy]-2-cyano-4-(2-methylphenyl)-2-phenoxy-butanoic acid

Systemtic Name: 3-[[3-(2-carboxyethyl)phenyl]methoxy]-2-cyano-4-(2-methylphenyl)-2-phenoxy-butanoic acid Openeye Name: 3-[[3-(2-carboxyethyl)phenyl]methoxy]-2-cyano-4-(o-tolyl)-2-phenoxy-butanoic acid CAS Name: 3-[[3-(2-carboxyethyl)phenyl]methoxy]-2-cyano-4-(2-methylphenyl)-2-phenoxybutanoic acid IUPAC Name: 3-[[3-(2-carboxyethyl)phenyl]methoxy]-2-cyano-4-(2-methylphenyl)-2-phenoxybutanoic acid Traditional Name: 3-[3-(2-carboxyethyl)benzyl]oxy-2-cyano-4-(o-tolyl)-2-phenoxy-butyric acid Formula: C28H27NO6 MolecularWeight: 473.51708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C(C#N)(C(=O)O)OC2=CC=CC=C2)OCC3=CC=CC(=C3)CCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1CC(C(C#N)(C(=O)O)OC2=CC=CC=C2)OCC3=CC=CC(=C3)CCC(=O)O

InChI

InChI=1S/C28H27NO6/c1-20-8-5-6-11-23(20)17-25(28(19-29,27(32)33)35-24-12-3-2-4-13-24)34-18-22-10-7-9-21(16-22)14-15-26(30)31/h2-13,16,25H,14-15,17-18H2,1H3,(H,30,31)(H,32,33)