(4-pyridin-2-yloxyphenyl) 2,1,3-benzothiadiazole-4-sulfonate

Systemtic Name: (4-pyridin-2-yloxyphenyl) 2,1,3-benzothiadiazole-4-sulfonate Openeye Name: [4-(2-pyridyloxy)phenyl] 2,1,3-benzothiadiazole-4-sulfonate CAS Name: 2,1,3-benzothiadiazole-4-sulfonic acid [4-(2-pyridinyloxy)phenyl] ester IUPAC Name: (4-pyridin-2-yloxyphenyl) 2,1,3-benzothiadiazole-4-sulfonate Traditional Name: piazthiole-4-sulfonic acid [4-(2-pyridyloxy)phenyl] ester Formula: C17H11N3O4S2 MolecularWeight: 385.41694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)OC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1=CC=NC(=C1)OC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H11N3O4S2/c21-26(22,15-5-3-4-14-17(15)20-25-19-14)24-13-9-7-12(8-10-13)23-16-6-1-2-11-18-16/h1-11H