4-oxidanylidene-1,2-dihydrobenzotriazole-5-carboxylic acid

Systemtic Name: 4-oxidanylidene-1,2-dihydrobenzotriazole-5-carboxylic acid Openeye Name: 4-oxo-1,2-dihydrobenzotriazole-5-carboxylic acid CAS Name: 4-oxo-1,2-dihydrobenzotriazole-5-carboxylic acid IUPAC Name: 4-oxo-1,2-dihydrobenzotriazole-5-carboxylic acid Traditional Name: 4-keto-1,2-dihydrobenzotriazole-5-carboxylic acid Formula: C7H5N3O3 MolecularWeight: 179.1329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)C2=NNNC2=C1)C(=O)O

Isomeric SMILES

C1=C(C(=O)C2=NNNC2=C1)C(=O)O

InChI

InChI=1S/C7H5N3O3/c11-6-3(7(12)13)1-2-4-5(6)9-10-8-4/h1-2,8,10H,(H,12,13)