3-[5-(3-ethoxycarbonylphenyl)carbonyl-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propanoic acid

Systemtic Name: 3-[5-(3-ethoxycarbonylphenyl)carbonyl-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propanoic acid Openeye Name: 3-[5-(3-ethoxycarbonylbenzoyl)-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propanoic acid CAS Name: 3-[5-[(3-ethoxycarbonylphenyl)-oxomethyl]-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propanoic acid IUPAC Name: 3-[5-(3-ethoxycarbonylbenzoyl)-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propanoic acid Traditional Name: 3-[5-(3-carbethoxybenzoyl)-2-[6-(2-methoxyphenyl)hexoxy]phenyl]propionic acid Formula: C32H36O7 MolecularWeight: 532.62404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C(=O)C2=CC(=C(C=C2)OCCCCCCC3=CC=CC=C3OC)CCC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C(=O)C2=CC(=C(C=C2)OCCCCCCC3=CC=CC=C3OC)CCC(=O)O

InChI

InChI=1S/C32H36O7/c1-3-38-32(36)27-14-10-13-25(22-27)31(35)26-16-18-29(24(21-26)17-19-30(33)34)39-20-9-5-4-6-11-23-12-7-8-15-28(23)37-2/h7-8,10,12-16,18,21-22H,3-6,9,11,17,19-20H2,1-2H3,(H,33,34)