3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methoxy-benzoate

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methoxy-benzoate Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methoxy-benzoate CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methoxybenzoate IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methoxybenzoate Traditional Name: 4-methoxy-3-(piazthiol-4-ylsulfonylamino)benzoate Formula: C14H10N3O5S2- MolecularWeight: 364.3763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C14H11N3O5S2/c1-22-11-6-5-8(14(18)19)7-10(11)17-24(20,21)12-4-2-3-9-13(12)16-23-15-9/h2-7,17H,1H3,(H,18,19)/p-1