3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate Traditional Name: 3-(piazthiol-4-ylsulfonylamino)propionate Formula: C9H8N3O4S2- MolecularWeight: 286.30752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NCCC(=O)[O-]

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NCCC(=O)[O-]

InChI

InChI=1S/C9H9N3O4S2/c13-8(14)4-5-10-18(15,16)7-3-1-2-6-9(7)12-17-11-6/h1-3,10H,4-5H2,(H,13,14)/p-1