methyl 4-[1-(4-cyclohexylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoate

Systemtic Name: methyl 4-[1-(4-cyclohexylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoate Openeye Name: methyl 4-[1-(4-cyclohexylphenyl)-5-oxo-pyrrolidin-3-yl]-2-methoxy-benzoate CAS Name: 4-[1-(4-cyclohexylphenyl)-5-oxo-3-pyrrolidinyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-cyclohexylphenyl)-5-oxopyrrolidin-3-yl]-2-methoxybenzoate Traditional Name: 4-[1-(4-cyclohexylphenyl)-5-keto-pyrrolidin-3-yl]-2-methoxy-benzoic acid methyl ester Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2CC(=O)N(C2)C3=CC=C(C=C3)C4CCCCC4)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C2CC(=O)N(C2)C3=CC=C(C=C3)C4CCCCC4)C(=O)OC

InChI

InChI=1S/C25H29NO4/c1-29-23-14-19(10-13-22(23)25(28)30-2)20-15-24(27)26(16-20)21-11-8-18(9-12-21)17-6-4-3-5-7-17/h8-14,17,20H,3-7,15-16H2,1-2H3