ethyl (2R,3R)-6-oxidanylidene-2-(3-phenylmethoxypropyl)-1-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (2R,3R)-6-oxidanylidene-2-(3-phenylmethoxypropyl)-1-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (2R,3R)-1-benzyl-2-(3-benzyloxypropyl)-6-oxo-piperidine-3-carboxylate CAS Name: (2R,3R)-6-oxo-2-(3-phenylmethoxypropyl)-1-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-1-benzyl-6-oxo-2-(3-phenylmethoxypropyl)piperidine-3-carboxylate Traditional Name: (2R,3R)-2-(3-benzoxypropyl)-1-benzyl-6-keto-nipecotic acid ethyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=O)N(C1CCCOCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1CCC(=O)N([C@@H]1CCCOCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H31NO4/c1-2-30-25(28)22-15-16-24(27)26(18-20-10-5-3-6-11-20)23(22)14-9-17-29-19-21-12-7-4-8-13-21/h3-8,10-13,22-23H,2,9,14-19H2,1H3/t22-,23-/m1/s1