N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-3-piperidin-1-yl-butanamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-3-piperidin-1-yl-butanamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-3-(1-piperidyl)butanamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-3-(1-piperidinyl)butanamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-3-piperidin-1-ylbutanamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-3-piperidino-butyramide Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC(CC1=CC=CC=C1)C(=O)N)N2CCCCC2

Isomeric SMILES

CC(CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)N2CCCCC2

InChI

InChI=1S/C18H27N3O2/c1-14(21-10-6-3-7-11-21)12-17(22)20-16(18(19)23)13-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13H2,1H3,(H2,19,23)(H,20,22)/t14?,16-/m0/s1