7-carboxy-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylate

Systemtic Name: 7-carboxy-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylate Openeye Name: 7-carboxy-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate CAS Name: 7-carboxy-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate IUPAC Name: 7-carboxy-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate Traditional Name: 7-carboxy-1,1,3-triketo-1,2-benzothiazole-6-carboxylate Formula: C9H4NO7S- MolecularWeight: 270.19556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1C(=O)NS2(=O)=O)C(=O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C2=C1C(=O)NS2(=O)=O)C(=O)O)C(=O)[O-]

InChI

InChI=1S/C9H5NO7S/c11-7-4-2-1-3(8(12)13)5(9(14)15)6(4)18(16,17)10-7/h1-2H,(H,10,11)(H,12,13)(H,14,15)/p-1