[2-methoxy-4-[3-oxidanylidene-7-(4-phenoxyphenyl)-5-(phenylcarbonyloxy)heptyl]phenyl] benzoate

Systemtic Name: [2-methoxy-4-[3-oxidanylidene-7-(4-phenoxyphenyl)-5-(phenylcarbonyloxy)heptyl]phenyl] benzoate Openeye Name: [4-[5-benzoyloxy-3-oxo-7-(4-phenoxyphenyl)heptyl]-2-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-[5-benzoyloxy-3-oxo-7-(4-phenoxyphenyl)heptyl]-2-methoxyphenyl] ester IUPAC Name: [4-[5-benzoyloxy-3-oxo-7-(4-phenoxyphenyl)heptyl]-2-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-[5-benzoyloxy-3-keto-7-(4-phenoxyphenyl)heptyl]-2-methoxy-phenyl] ester Formula: C40H36O7 MolecularWeight: 628.70964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC(=O)CC(CCC2=CC=C(C=C2)OC3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)CCC(=O)CC(CCC2=CC=C(C=C2)OC3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C40H36O7/c1-44-38-27-30(21-26-37(38)47-40(43)32-13-7-3-8-14-32)17-22-33(41)28-36(46-39(42)31-11-5-2-6-12-31)25-20-29-18-23-35(24-19-29)45-34-15-9-4-10-16-34/h2-16,18-19,21,23-24,26-27,36H,17,20,22,25,28H2,1H3