methyl (3S,4S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxidanylidene-4-phenyl-piperidine-3-carboxylate

Systemtic Name: methyl (3S,4S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxidanylidene-4-phenyl-piperidine-3-carboxylate Openeye Name: methyl (3S,4S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4-phenyl-piperidine-3-carboxylate CAS Name: (3S,4S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4-phenyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-4-phenylpiperidine-3-carboxylate Traditional Name: (3S,4S)-1-homoveratryl-6-keto-4-phenyl-nipecotic acid methyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(C(CC2=O)C3=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C[C@H]([C@H](CC2=O)C3=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C23H27NO5/c1-27-20-10-9-16(13-21(20)28-2)11-12-24-15-19(23(26)29-3)18(14-22(24)25)17-7-5-4-6-8-17/h4-10,13,18-19H,11-12,14-15H2,1-3H3/t18-,19-/m1/s1