4-[[2-(2-carboxyethyl)-4-(4-cyclopentyloxy-2-oxidanyl-phenyl)carbonyl-phenoxy]methyl]-2-methoxy-benzoic acid

Systemtic Name: 4-[[2-(2-carboxyethyl)-4-(4-cyclopentyloxy-2-oxidanyl-phenyl)carbonyl-phenoxy]methyl]-2-methoxy-benzoic acid Openeye Name: 4-[[2-(2-carboxyethyl)-4-[4-(cyclopentoxy)-2-hydroxy-benzoyl]phenoxy]methyl]-2-methoxy-benzoic acid CAS Name: 4-[[2-(2-carboxyethyl)-4-[(4-cyclopentyloxy-2-hydroxyphenyl)-oxomethyl]phenoxy]methyl]-2-methoxybenzoic acid IUPAC Name: 4-[[2-(2-carboxyethyl)-4-(4-cyclopentyloxy-2-hydroxybenzoyl)phenoxy]methyl]-2-methoxybenzoic acid Traditional Name: 4-[[2-(2-carboxyethyl)-4-[4-(cyclopentoxy)-2-hydroxy-benzoyl]phenoxy]methyl]-2-methoxy-benzoic acid Formula: C30H30O9 MolecularWeight: 534.5538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)COC2=C(C=C(C=C2)C(=O)C3=C(C=C(C=C3)OC4CCCC4)O)CCC(=O)O)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)COC2=C(C=C(C=C2)C(=O)C3=C(C=C(C=C3)OC4CCCC4)O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C30H30O9/c1-37-27-14-18(6-10-24(27)30(35)36)17-38-26-12-7-20(15-19(26)8-13-28(32)33)29(34)23-11-9-22(16-25(23)31)39-21-4-2-3-5-21/h6-7,9-12,14-16,21,31H,2-5,8,13,17H2,1H3,(H,32,33)(H,35,36)