3-[2-(carboxymethyl)-6-[(3,4-dipentoxyphenyl)methoxy]phenyl]benzoic acid

Systemtic Name: 3-[2-(carboxymethyl)-6-[(3,4-dipentoxyphenyl)methoxy]phenyl]benzoic acid Openeye Name: 3-[2-(carboxymethyl)-6-[(3,4-dipentoxyphenyl)methoxy]phenyl]benzoic acid CAS Name: 3-[2-(carboxymethyl)-6-[(3,4-dipentoxyphenyl)methoxy]phenyl]benzoic acid IUPAC Name: 3-[2-(carboxymethyl)-6-[(3,4-dipentoxyphenyl)methoxy]phenyl]benzoic acid Traditional Name: 3-[2-(carboxymethyl)-6-(3,4-diamoxybenzyl)oxy-phenyl]benzoic acid Formula: C32H38O7 MolecularWeight: 534.63992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)COC2=CC=CC(=C2C3=CC(=CC=C3)C(=O)O)CC(=O)O)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)COC2=CC=CC(=C2C3=CC(=CC=C3)C(=O)O)CC(=O)O)OCCCCC

InChI

InChI=1S/C32H38O7/c1-3-5-7-17-37-27-16-15-23(19-29(27)38-18-8-6-4-2)22-39-28-14-10-12-25(21-30(33)34)31(28)24-11-9-13-26(20-24)32(35)36/h9-16,19-20H,3-8,17-18,21-22H2,1-2H3,(H,33,34)(H,35,36)