3-(2,1,3-benzothiadiazol-4-ylsulfonylazanidyl)benzoate

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylazanidyl)benzoate Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylazanidyl)benzoate CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylazanidyl)benzoate IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylazanidyl)benzoate Traditional Name: 3-piazthiol-4-ylsulfonylazanidylbenzoate Formula: C13H7N3O4S2-2 MolecularWeight: 333.34238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N-]S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N-]S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)[O-]

InChI

InChI=1S/C13H8N3O4S2/c17-13(18)8-3-1-4-9(7-8)16-22(19,20)11-6-2-5-10-12(11)15-21-14-10/h1-7H,(H,17,18)/q-1/p-1