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

Systemtic Name: ethyl (2S,3R)-6-oxidanylidene-2-(phenylmethoxymethyl)-1-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (2S,3R)-1-benzyl-2-(benzyloxymethyl)-6-oxo-piperidine-3-carboxylate CAS Name: (2S,3R)-6-oxo-2-(phenylmethoxymethyl)-1-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-1-benzyl-6-oxo-2-(phenylmethoxymethyl)piperidine-3-carboxylate Traditional Name: (2S,3R)-2-(benzoxymethyl)-1-benzyl-6-keto-nipecotic acid ethyl ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=O)N(C1COCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1CCC(=O)N([C@@H]1COCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H27NO4/c1-2-28-23(26)20-13-14-22(25)24(15-18-9-5-3-6-10-18)21(20)17-27-16-19-11-7-4-8-12-19/h3-12,20-21H,2,13-17H2,1H3/t20-,21-/m1/s1