phenyl 2,1,3-benzothiadiazole-5-carboxylate

Systemtic Name: phenyl 2,1,3-benzothiadiazole-5-carboxylate Openeye Name: phenyl 2,1,3-benzothiadiazole-5-carboxylate CAS Name: 2,1,3-benzothiadiazole-5-carboxylic acid phenyl ester IUPAC Name: phenyl 2,1,3-benzothiadiazole-5-carboxylate Traditional Name: piazthiole-5-carboxylic acid phenyl ester Formula: C13H8N2O2S MolecularWeight: 256.27982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC3=NSN=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC3=NSN=C3C=C2

InChI

InChI=1S/C13H8N2O2S/c16-13(17-10-4-2-1-3-5-10)9-6-7-11-12(8-9)15-18-14-11/h1-8H