[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] (2R,3S)-1-butyl-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] (2R,3S)-1-butyl-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] (2R,3S)-1-butyl-6-oxo-2-phenyl-piperidine-3-carboxylate CAS Name: (2R,3S)-1-butyl-6-oxo-2-phenyl-3-piperidinecarboxylic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] (2R,3S)-1-butyl-6-oxo-2-phenylpiperidine-3-carboxylate Traditional Name: (2R,3S)-1-butyl-6-keto-2-phenyl-nipecotic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C24H26ClNO4 MolecularWeight: 427.92054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)OCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCN1[C@H]([C@H](CCC1=O)C(=O)OCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C24H26ClNO4/c1-2-3-15-26-22(28)14-13-20(23(26)18-7-5-4-6-8-18)24(29)30-16-21(27)17-9-11-19(25)12-10-17/h4-12,20,23H,2-3,13-16H2,1H3/t20-,23-/m0/s1