N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-phenyl-propanamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-phenyl-propanamide Openeye Name: N-[(1S)-2-(azepan-1-yl)-1-(hydroxymethyl)-2-oxo-ethyl]-2-phenyl-propanamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-hydroxy-1-oxopropan-2-yl]-2-phenylpropanamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-hydroxy-1-oxopropan-2-yl]-2-phenylpropanamide Traditional Name: N-[(1S)-2-(azepan-1-yl)-2-keto-1-methylol-ethyl]-2-phenyl-propionamide Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)NC(CO)C(=O)N2CCCCCC2

Isomeric SMILES

CC(C1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N2CCCCCC2

InChI

InChI=1S/C18H26N2O3/c1-14(15-9-5-4-6-10-15)17(22)19-16(13-21)18(23)20-11-7-2-3-8-12-20/h4-6,9-10,14,16,21H,2-3,7-8,11-13H2,1H3,(H,19,22)/t14?,16-/m0/s1