methyl 8-ethoxy-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate

Systemtic Name: methyl 8-ethoxy-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate Openeye Name: methyl 8-ethoxy-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate CAS Name: 8-ethoxy-5-oxido-3-pyrazolo[5,1-c][1,2,4]benzotriazin-5-iumcarboxylic acid methyl ester IUPAC Name: methyl 8-ethoxy-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate Traditional Name: 8-ethoxy-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid methyl ester Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)C(=O)OC)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)C(=O)OC)[O-]

InChI

InChI=1S/C13H12N4O4/c1-3-21-8-4-5-10-11(6-8)16-12(15-17(10)19)9(7-14-16)13(18)20-2/h4-7H,3H2,1-2H3