2-methyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylic acid

Systemtic Name: 2-methyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylic acid Openeye Name: 2-methyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid CAS Name: 2-methyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid IUPAC Name: 2-methyl-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid Traditional Name: 1,1,3-triketo-2-methyl-1,2-benzothiazole-6-carboxylic acid Formula: C9H7NO5S MolecularWeight: 241.22058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)C(=O)O

InChI

InChI=1S/C9H7NO5S/c1-10-8(11)6-3-2-5(9(12)13)4-7(6)16(10,14)15/h2-4H,1H3,(H,12,13)