6-Chloropenicillanic Acid S-Sulfoxide
[CAS# 97729-66-3]

Identification

• Name: 6-Chloropenicillanic Acid S-Sulfoxide
• Synonyms: (2S,5R,6S)-6-Chloro-4,7-Diketo-3,3-Dimethyl-4$L^{4}-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; 6-Chloropenicillanic Acid S-Sulfoxide; Cass
• Molecular Formula: C₈H₁₀ClNO₄S
• Molecular Weight: 251.68
• CAS Registry Number: 97729-66-3
• SMILES: [C@@H]1(C([S]([C@H]2N1C([C@@H]2Cl)=O)=O)(C)C)C(=O)O
• InChI: 1S/C8H10ClNO4S/c1-8(2)4(7(12)13)10-5(11)3(9)6(10)15(8)14/h3-4,6H,1-2H3,(H,12,13)/t3-,4-,6+,15?/m0/s1
• InChIKey: HLDIDPSLBNPWBL-AMVCQHSUSA-N