4-(phenylmethyl)azepan-3-one hydrochloride

Systemtic Name: 4-(phenylmethyl)azepan-3-one hydrochloride Openeye Name: 4-benzylazepan-3-one hydrochloride CAS Name: 4-(phenylmethyl)-3-azepanone hydrochloride IUPAC Name: 4-benzylazepan-3-one hydrochloride Traditional Name: 4-benzylazepan-3-one hydrochloride Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)CNC1)CC2=CC=CC=C2.Cl

Isomeric SMILES

C1CC(C(=O)CNC1)CC2=CC=CC=C2.Cl

InChI

InChI=1S/C13H17NO.ClH/c15-13-10-14-8-4-7-12(13)9-11-5-2-1-3-6-11;/h1-3,5-6,12,14H,4,7-10H2;1H