3-(3-oxidanylidene-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propanoate

Systemtic Name: 3-(3-oxidanylidene-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propanoate Openeye Name: 3-(3-oxo-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propanoate CAS Name: 3-(3-oxo-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propanoate IUPAC Name: 3-(3-oxo-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propanoate Traditional Name: 3-(3-keto-5H-[1,2,4]triazino[2,3-a]benzimidazol-2-yl)propionate Formula: C12H9N4O3- MolecularWeight: 257.22486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3=NC(=O)C(=NN23)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC3=NC(=O)C(=NN23)CCC(=O)[O-]

InChI

InChI=1S/C12H10N4O3/c17-10(18)6-5-8-11(19)14-12-13-7-3-1-2-4-9(7)16(12)15-8/h1-4H,5-6H2,(H,17,18)(H,13,14,19)/p-1