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

Systemtic Name: 3-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one hydrochloride Openeye Name: 3-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one hydrochloride CAS Name: 3-(1-azepanyl)-1-(4-methoxyphenyl)-1-propanone hydrochloride IUPAC Name: 3-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one hydrochloride Traditional Name: 3-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one hydrochloride Formula: C16H24ClNO2 MolecularWeight: 297.82026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CCN2CCCCCC2.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CCN2CCCCCC2.Cl

InChI

InChI=1S/C16H23NO2.ClH/c1-19-15-8-6-14(7-9-15)16(18)10-13-17-11-4-2-3-5-12-17;/h6-9H,2-5,10-13H2,1H3;1H