methyl (3S)-4-oxidanylidene-4-phenylazanyl-3-piperidin-1-yl-butanoate

Systemtic Name: methyl (3S)-4-oxidanylidene-4-phenylazanyl-3-piperidin-1-yl-butanoate Openeye Name: methyl (3S)-4-anilino-4-oxo-3-(1-piperidyl)butanoate CAS Name: (3S)-4-anilino-4-oxo-3-(1-piperidinyl)butanoic acid methyl ester IUPAC Name: methyl (3S)-4-anilino-4-oxo-3-piperidin-1-ylbutanoate Traditional Name: (3S)-4-anilino-4-keto-3-piperidino-butyric acid methyl ester Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)NC1=CC=CC=C1)N2CCCCC2

Isomeric SMILES

COC(=O)C[C@@H](C(=O)NC1=CC=CC=C1)N2CCCCC2

InChI

InChI=1S/C16H22N2O3/c1-21-15(19)12-14(18-10-6-3-7-11-18)16(20)17-13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3,(H,17,20)/t14-/m0/s1