methyl 4-[7-[(1-cyclohexyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]naphthalen-2-yl]benzoate

Systemtic Name: methyl 4-[7-[(1-cyclohexyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]naphthalen-2-yl]benzoate Openeye Name: methyl 4-[7-[(1-cyclohexyl-2-oxo-pyrrolidin-3-yl)methyl]-2-naphthyl]benzoate CAS Name: 4-[7-[(1-cyclohexyl-2-oxo-3-pyrrolidinyl)methyl]-2-naphthalenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[7-[(1-cyclohexyl-2-oxopyrrolidin-3-yl)methyl]naphthalen-2-yl]benzoate Traditional Name: 4-[7-[(1-cyclohexyl-2-keto-pyrrolidin-3-yl)methyl]-2-naphthyl]benzoic acid methyl ester Formula: C29H31NO3 MolecularWeight: 441.56134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=CC(=C3)CC4CCN(C4=O)C5CCCCC5)C=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=CC(=C3)CC4CCN(C4=O)C5CCCCC5)C=C2

InChI

InChI=1S/C29H31NO3/c1-33-29(32)23-12-9-21(10-13-23)24-14-11-22-8-7-20(18-26(22)19-24)17-25-15-16-30(28(25)31)27-5-3-2-4-6-27/h7-14,18-19,25,27H,2-6,15-17H2,1H3