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

Systemtic Name: ethyl (2S,3S)-2-methyl-6-oxidanylidene-1-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (2S,3S)-1-benzyl-2-methyl-6-oxo-piperidine-3-carboxylate CAS Name: (2S,3S)-2-methyl-6-oxo-1-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3S)-1-benzyl-2-methyl-6-oxopiperidine-3-carboxylate Traditional Name: (2S,3S)-1-benzyl-6-keto-2-methyl-nipecotic acid ethyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=O)N(C1C)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1CCC(=O)N([C@H]1C)CC2=CC=CC=C2

InChI

InChI=1S/C16H21NO3/c1-3-20-16(19)14-9-10-15(18)17(12(14)2)11-13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3/t12-,14-/m0/s1