ethyl (3S)-1-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[(1S)-2-anilino-1-methyl-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2S)-1-anilino-1-oxopropan-2-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(2S)-1-anilino-1-oxopropan-2-yl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(1S)-2-anilino-2-keto-1-methyl-ethyl]nipecotic acid ethyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)[C@@H](C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O3/c1-3-22-17(21)14-8-7-11-19(12-14)13(2)16(20)18-15-9-5-4-6-10-15/h4-6,9-10,13-14H,3,7-8,11-12H2,1-2H3,(H,18,20)/t13-,14-/m0/s1