(phenylmethyl) (2S,3R)-3-oxidanyl-2-(3-oxidanylidenepropyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,3R)-3-oxidanyl-2-(3-oxidanylidenepropyl)piperidine-1-carboxylate Openeye Name: benzyl (2S,3R)-3-hydroxy-2-(3-oxopropyl)piperidine-1-carboxylate CAS Name: (2S,3R)-3-hydroxy-2-(3-oxopropyl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-hydroxy-2-(3-oxopropyl)piperidine-1-carboxylate Traditional Name: (2S,3R)-3-hydroxy-2-(3-ketopropyl)piperidine-1-carboxylic acid benzyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C(=O)OCC2=CC=CC=C2)CCC=O)O

Isomeric SMILES

C1C[C@H]([C@@H](N(C1)C(=O)OCC2=CC=CC=C2)CCC=O)O

InChI

InChI=1S/C16H21NO4/c18-11-5-8-14-15(19)9-4-10-17(14)16(20)21-12-13-6-2-1-3-7-13/h1-3,6-7,11,14-15,19H,4-5,8-10,12H2/t14-,15+/m0/s1