2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]sulfonyl]benzoic acid

Systemtic Name: 2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]sulfonyl]benzoic acid Openeye Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)sulfonyl]benzoic acid CAS Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)sulfonyl]benzoic acid IUPAC Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)sulfonyl]benzoic acid Traditional Name: 2-[(1,1,3-triketo-1,2-benzothiazol-2-yl)sulfonyl]benzoic acid Formula: C14H9NO7S2 MolecularWeight: 367.35376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C14H9NO7S2/c16-13-9-5-1-3-7-11(9)23(19,20)15(13)24(21,22)12-8-4-2-6-10(12)14(17)18/h1-8H,(H,17,18)