phenyl (2R,3S)-1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate

Systemtic Name: phenyl (2R,3S)-1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate Openeye Name: phenyl (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenyl-piperidine-3-carboxylate CAS Name: (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenyl-3-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenylpiperidine-3-carboxylate Traditional Name: (2R,3S)-6-keto-1-(4-methoxyphenyl)-2-phenyl-nipecotic acid phenyl ester Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@H]([C@H](CCC2=O)C(=O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23NO4/c1-29-20-14-12-19(13-15-20)26-23(27)17-16-22(24(26)18-8-4-2-5-9-18)25(28)30-21-10-6-3-7-11-21/h2-15,22,24H,16-17H2,1H3/t22-,24-/m0/s1