2-(4-oxidanylidene-1,2-dihydrobenzotriazol-5-yl)ethanoic acid

Systemtic Name: 2-(4-oxidanylidene-1,2-dihydrobenzotriazol-5-yl)ethanoic acid Openeye Name: 2-(4-oxo-1,2-dihydrobenzotriazol-5-yl)acetic acid CAS Name: 2-(4-oxo-1,2-dihydrobenzotriazol-5-yl)acetic acid IUPAC Name: 2-(4-oxo-1,2-dihydrobenzotriazol-5-yl)acetic acid Traditional Name: 2-(4-keto-1,2-dihydrobenzotriazol-5-yl)acetic acid Formula: C8H7N3O3 MolecularWeight: 193.15948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7N3O3/c12-6(13)3-4-1-2-5-7(8(4)14)10-11-9-5/h1-2,9,11H,3H2,(H,12,13)