1,2-benzothiazole 1,1-dioxide; ethanoic acid

Systemtic Name: 1,2-benzothiazole 1,1-dioxide; ethanoic acid Openeye Name: acetic acid; 1,2-benzothiazole 1,1-dioxide CAS Name: acetic acid; 1,2-benzothiazole 1,1-dioxide IUPAC Name: acetic acid; 1,2-benzothiazole 1,1-dioxide Traditional Name: acetic acid; 1,2-benzothiazole 1,1-dioxide Formula: C9H9NO4S MolecularWeight: 227.23706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C2C(=C1)C=NS2(=O)=O

Isomeric SMILES

CC(=O)O.C1=CC=C2C(=C1)C=NS2(=O)=O

InChI

InChI=1S/C7H5NO2S.C2H4O2/c9-11(10)7-4-2-1-3-6(7)5-8-11;1-2(3)4/h1-5H;1H3,(H,3,4)