1-[2-(phenylsulfinyl)ethyl]azepane hydrochloride

Systemtic Name: 1-[2-(phenylsulfinyl)ethyl]azepane hydrochloride Openeye Name: 1-[2-(benzenesulfinyl)ethyl]azepane hydrochloride CAS Name: 1-[2-(benzenesulfinyl)ethyl]azepane hydrochloride IUPAC Name: 1-[2-(benzenesulfinyl)ethyl]azepane hydrochloride Traditional Name: 1-[2-(benzenesulfinyl)ethyl]azepane hydrochloride Formula: C14H22ClNOS MolecularWeight: 287.84858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCS(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

C1CCCN(CC1)CCS(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C14H21NOS.ClH/c16-17(14-8-4-3-5-9-14)13-12-15-10-6-1-2-7-11-15;/h3-5,8-9H,1-2,6-7,10-13H2;1H