3-[2-[6-(4-ethanoylphenyl)hexoxy]-5-(3-ethoxycarbonylphenyl)carbonyl-phenyl]propanoic acid

Systemtic Name: 3-[2-[6-(4-ethanoylphenyl)hexoxy]-5-(3-ethoxycarbonylphenyl)carbonyl-phenyl]propanoic acid Openeye Name: 3-[2-[6-(4-acetylphenyl)hexoxy]-5-(3-ethoxycarbonylbenzoyl)phenyl]propanoic acid CAS Name: 3-[2-[6-(4-acetylphenyl)hexoxy]-5-[(3-ethoxycarbonylphenyl)-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[2-[6-(4-acetylphenyl)hexoxy]-5-(3-ethoxycarbonylbenzoyl)phenyl]propanoic acid Traditional Name: 3-[2-[6-(4-acetylphenyl)hexoxy]-5-(3-carbethoxybenzoyl)phenyl]propionic acid Formula: C33H36O7 MolecularWeight: 544.63474

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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=C(C=C3)C(=O)C)CCC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C(=O)C2=CC(=C(C=C2)OCCCCCCC3=CC=C(C=C3)C(=O)C)CCC(=O)O

InChI

InChI=1S/C33H36O7/c1-3-39-33(38)29-11-8-10-27(22-29)32(37)28-16-18-30(26(21-28)17-19-31(35)36)40-20-7-5-4-6-9-24-12-14-25(15-13-24)23(2)34/h8,10-16,18,21-22H,3-7,9,17,19-20H2,1-2H3,(H,35,36)