3-[2-Chloro-4-(Methylsulfonyl)Benzoyl]-4-(Phenylthio)-Bicyclo[3.2.1]Oct-3-En-2-One
[CAS# 156963-66-5]

Identification

• Name: 3-[2-Chloro-4-(Methylsulfonyl)Benzoyl]-4-(Phenylthio)-Bicyclo[3.2.1]Oct-3-En-2-One
• Synonyms: 3-(2-CHLORO-4-METHYLBENZOYL)-4-PHENYLTHIOBICYCLO[3,2,1]OCT-2-EN-4-ONE; Benzobicyclon (Bsi, Pa Iso); BENZOBICYCLON STANDARD
• Molecular Formula: C₂₂H₁₉ClO₄S₂
• Molecular Weight: 446.97
• CAS Registry Number: 156963-66-5
• SMILES: O=C1[C@@H]2CC[C@@H](C2)C(=C1C(=O)c1ccc(cc1Cl)S(=O)(=O)C)Sc1ccccc1
• InChI: 1S/C22H19ClO4S2/c1-29(26,27)16-9-10-17(18(23)12-16)21(25)19-20(24)13-7-8-14(11-13)22(19)28-15-5-3-2-4-6-15/h2-6,9-10,12-14H,7-8,11H2,1H3/t13-,14+/m1/s1