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

Systemtic Name: phenyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: phenyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxylate CAS Name: (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: (2R,3S)-1-butyl-6-keto-2-(2-methoxyphenyl)nipecotic acid phenyl ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)OC2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

CCCCN1[C@H]([C@H](CCC1=O)C(=O)OC2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C23H27NO4/c1-3-4-16-24-21(25)15-14-19(23(26)28-17-10-6-5-7-11-17)22(24)18-12-8-9-13-20(18)27-2/h5-13,19,22H,3-4,14-16H2,1-2H3/t19-,22-/m0/s1