8-chloranyl-5H-1,5-benzothiazepin-4-one hydrochloride

Systemtic Name: 8-chloranyl-5H-1,5-benzothiazepin-4-one hydrochloride Openeye Name: 8-chloro-5H-1,5-benzothiazepin-4-one hydrochloride CAS Name: 8-chloro-5H-1,5-benzothiazepin-4-one hydrochloride IUPAC Name: 8-chloro-5H-1,5-benzothiazepin-4-one hydrochloride Traditional Name: 8-chloro-5H-1,5-benzothiazepin-4-one hydrochloride Formula: C9H7Cl2NOS MolecularWeight: 248.12898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC=CC(=O)N2.Cl

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC=CC(=O)N2.Cl

InChI

InChI=1S/C9H6ClNOS.ClH/c10-6-1-2-7-8(5-6)13-4-3-9(12)11-7;/h1-5H,(H,11,12);1H