4-(8-Chloro-5,6-Dihydrobenzo[b][1]Benzothiepin-6-Yl)-1-Methyl-1-Oxidopiperazin-1-Ium
[CAS# 32860-00-7]

Identification

• Name: 4-(8-Chloro-5,6-Dihydrobenzo[b][1]Benzothiepin-6-Yl)-1-Methyl-1-Oxidopiperazin-1-Ium
• Synonyms: 4-(8-Chloro-5,6-Dihydrobenzo[B][1]Benzothiepin-6-Yl)-1-Methyl-1-Oxido-Piperazin-1-Ium; Clotepin-N-Oxide; Octoclothepine-N-Oxide
• Molecular Formula: C₁₉H₂₁ClN₂OS
• Molecular Weight: 360.90
• CAS Registry Number: 32860-00-7
• SMILES: C4=C3C(N1CC[N+]([O-])(CC1)C)CC2=CC=CC=C2SC3=CC=C4Cl
• InChI: 1S/C19H21ClN2OS/c1-22(23)10-8-21(9-11-22)17-12-14-4-2-3-5-18(14)24-19-7-6-15(20)13-16(17)19/h2-7,13,17H,8-12H2,1H3
• InChIKey: CJKJEPBXTDYWHH-UHFFFAOYSA-N