2-(2,1,3-benzothiadiazol-4-yl)ethanoic acid

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-yl)ethanoic acid Openeye Name: 2-(2,1,3-benzothiadiazol-4-yl)acetic acid CAS Name: 2-(2,1,3-benzothiadiazol-4-yl)acetic acid IUPAC Name: 2-(2,1,3-benzothiadiazol-4-yl)acetic acid Traditional Name: 2-piazthiol-4-ylacetic acid Formula: C8H6N2O2S MolecularWeight: 194.21044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)CC(=O)O

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)CC(=O)O

InChI

InChI=1S/C8H6N2O2S/c11-7(12)4-5-2-1-3-6-8(5)10-13-9-6/h1-3H,4H2,(H,11,12)