ethyl 4-methyl-[1,2,3]triazino[1,2-a]benzotriazol-5-ium-2-carboxylate

Systemtic Name: ethyl 4-methyl-[1,2,3]triazino[1,2-a]benzotriazol-5-ium-2-carboxylate Openeye Name: ethyl 4-methyltriazino[1,2-a]benzotriazol-5-ium-2-carboxylate CAS Name: 4-methyl-2-triazino[1,2-a]benzotriazol-5-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyltriazino[1,2-a]benzotriazol-5-ium-2-carboxylate Traditional Name: 4-methyltriazino[1,2-a]benzotriazol-5-ium-2-carboxylic acid ethyl ester Formula: C13H13N4O2+ MolecularWeight: 257.26792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2N=C3C=CC=CC3=[N+]2C(=C1)C

Isomeric SMILES

CCOC(=O)C1=NN2N=C3C=CC=CC3=[N+]2C(=C1)C

InChI

InChI=1S/C13H13N4O2/c1-3-19-13(18)11-8-9(2)16-12-7-5-4-6-10(12)14-17(16)15-11/h4-8H,3H2,1-2H3/q+1