methyl 4-[6-[(1-cyclohexyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]naphthalen-1-yl]benzoate

Systemtic Name: methyl 4-[6-[(1-cyclohexyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]naphthalen-1-yl]benzoate Openeye Name: methyl 4-[6-[(1-cyclohexyl-2-oxo-pyrrolidin-3-yl)methyl]-1-naphthyl]benzoate CAS Name: 4-[6-[(1-cyclohexyl-2-oxo-3-pyrrolidinyl)methyl]-1-naphthalenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[6-[(1-cyclohexyl-2-oxopyrrolidin-3-yl)methyl]naphthalen-1-yl]benzoate Traditional Name: 4-[6-[(1-cyclohexyl-2-keto-pyrrolidin-3-yl)methyl]-1-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=CC=CC3=C2C=CC(=C3)CC4CCN(C4=O)C5CCCCC5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC=CC3=C2C=CC(=C3)CC4CCN(C4=O)C5CCCCC5

InChI

InChI=1S/C29H31NO3/c1-33-29(32)22-13-11-21(12-14-22)26-9-5-6-23-18-20(10-15-27(23)26)19-24-16-17-30(28(24)31)25-7-3-2-4-8-25/h5-6,9-15,18,24-25H,2-4,7-8,16-17,19H2,1H3