5-(2,1,3-benzothiadiazol-4-ylsulfonylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(2,1,3-benzothiadiazol-4-ylsulfonylamino)benzene-1,3-dicarboxylic acid Openeye Name: 5-(2,1,3-benzothiadiazol-4-ylsulfonylamino)benzene-1,3-dicarboxylic acid CAS Name: 5-(2,1,3-benzothiadiazol-4-ylsulfonylamino)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(2,1,3-benzothiadiazol-4-ylsulfonylamino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(piazthiol-4-ylsulfonylamino)isophthalic acid Formula: C14H9N3O6S2 MolecularWeight: 379.36776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C14H9N3O6S2/c18-13(19)7-4-8(14(20)21)6-9(5-7)17-25(22,23)11-3-1-2-10-12(11)16-24-15-10/h1-6,17H,(H,18,19)(H,20,21)