ethyl (2R,3R)-5-acetamido-6-oxidanylidene-1,2-bis(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (2R,3R)-5-acetamido-6-oxidanylidene-1,2-bis(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (2R,3R)-5-acetamido-1,2-dibenzyl-6-oxo-piperidine-3-carboxylate CAS Name: (2R,3R)-5-acetamido-6-oxo-1,2-bis(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-5-acetamido-1,2-dibenzyl-6-oxopiperidine-3-carboxylate Traditional Name: (2R,3R)-5-acetamido-1,2-dibenzyl-6-keto-nipecotic acid ethyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(=O)N(C1CC2=CC=CC=C2)CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)[C@@H]1CC(C(=O)N([C@@H]1CC2=CC=CC=C2)CC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C24H28N2O4/c1-3-30-24(29)20-15-21(25-17(2)27)23(28)26(16-19-12-8-5-9-13-19)22(20)14-18-10-6-4-7-11-18/h4-13,20-22H,3,14-16H2,1-2H3,(H,25,27)/t20-,21?,22-/m1/s1