(1,1,3-Trioxo-1,3-Dihydro-1lambda6-Benzo[d]Isothiazol-2-Yl)-Acetonitrile
[CAS# 52188-12-2]

Identification

• Name: (1,1,3-Trioxo-1,3-Dihydro-1lambda6-Benzo[d]Isothiazol-2-Yl)-Acetonitrile
• Synonyms: 2-(1,1,3-Triketo-1,2-Benzothiazol-2-Yl)Acetonitrile; 2-(1,1,3-Trioxo-1,2-Benzothiazol-2-Yl)Ethanenitrile; Sdccgmls-0065857.P001
• Molecular Formula: C₉H₆N₂O₃S
• Molecular Weight: 222.22
• CAS Registry Number: 52188-12-2
• SMILES: C1=CC=CC2=C1C(N(CC#N)[S]2(=O)=O)=O
• InChI: 1S/C9H6N2O3S/c10-5-6-11-9(12)7-3-1-2-4-8(7)15(11,13)14/h1-4H,6H2
• InChIKey: XOOUGZKBOROESV-UHFFFAOYSA-N