[1-methyl-3-[2-oxidanylidene-1-(2-oxidanylidenecyclohexyl)-2-phenyl-ethyl]indol-2-yl] benzoate

Systemtic Name: [1-methyl-3-[2-oxidanylidene-1-(2-oxidanylidenecyclohexyl)-2-phenyl-ethyl]indol-2-yl] benzoate Openeye Name: [1-methyl-3-[2-oxo-1-(2-oxocyclohexyl)-2-phenyl-ethyl]indol-2-yl] benzoate CAS Name: benzoic acid [1-methyl-3-[2-oxo-1-(2-oxocyclohexyl)-2-phenylethyl]-2-indolyl] ester IUPAC Name: [1-methyl-3-[2-oxo-1-(2-oxocyclohexyl)-2-phenylethyl]indol-2-yl] benzoate Traditional Name: benzoic acid [3-[2-keto-1-(2-ketocyclohexyl)-2-phenyl-ethyl]-1-methyl-indol-2-yl] ester Formula: C30H27NO4 MolecularWeight: 465.53968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1OC(=O)C3=CC=CC=C3)C(C4CCCCC4=O)C(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1OC(=O)C3=CC=CC=C3)C(C4CCCCC4=O)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H27NO4/c1-31-24-18-10-8-16-22(24)27(29(31)35-30(34)21-14-6-3-7-15-21)26(23-17-9-11-19-25(23)32)28(33)20-12-4-2-5-13-20/h2-8,10,12-16,18,23,26H,9,11,17,19H2,1H3