3-(azepan-1-yl)-1-(4-chlorophenyl)propan-1-one hydrochloride

Systemtic Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)propan-1-one hydrochloride Openeye Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)propan-1-one hydrochloride CAS Name: 3-(1-azepanyl)-1-(4-chlorophenyl)-1-propanone hydrochloride IUPAC Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)propan-1-one hydrochloride Traditional Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)propan-1-one hydrochloride Formula: C15H21Cl2NO MolecularWeight: 302.23934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCC(=O)C2=CC=C(C=C2)Cl.Cl

Isomeric SMILES

C1CCCN(CC1)CCC(=O)C2=CC=C(C=C2)Cl.Cl

InChI

InChI=1S/C15H20ClNO.ClH/c16-14-7-5-13(6-8-14)15(18)9-12-17-10-3-1-2-4-11-17;/h5-8H,1-4,9-12H2;1H