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

Systemtic Name: 2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]benzoic acid Openeye Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzoic acid CAS Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzoic acid IUPAC Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzoic acid Traditional Name: 2-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]benzoic acid Formula: C15H11NO5S MolecularWeight: 317.31654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C(=O)O

InChI

InChI=1S/C15H11NO5S/c17-14-12-7-3-4-8-13(12)22(20,21)16(14)9-10-5-1-2-6-11(10)15(18)19/h1-8H,9H2,(H,18,19)