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

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopentane-1-carboxamide Openeye Name: N-[(1S)-2-(azepan-1-yl)-1-(hydroxymethyl)-2-oxo-ethyl]-1-phenyl-cyclopentanecarboxamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-hydroxy-1-oxopropan-2-yl]-1-phenyl-1-cyclopentanecarboxamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-hydroxy-1-oxopropan-2-yl]-1-phenylcyclopentane-1-carboxamide Traditional Name: N-[(1S)-2-(azepan-1-yl)-2-keto-1-methylol-ethyl]-1-phenyl-cyclopentanecarboxamide Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(CO)NC(=O)C2(CCCC2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@H](CO)NC(=O)C2(CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H30N2O3/c24-16-18(19(25)23-14-8-1-2-9-15-23)22-20(26)21(12-6-7-13-21)17-10-4-3-5-11-17/h3-5,10-11,18,24H,1-2,6-9,12-16H2,(H,22,26)/t18-/m0/s1