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

Systemtic Name: (2-methoxyphenyl)methyl 8-ethoxy-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate Openeye Name: (2-methoxyphenyl)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 (2-methoxyphenyl)methyl ester IUPAC Name: (2-methoxyphenyl)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 o-anisyl ester Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)C(=O)OCC4=CC=CC=C4OC)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)C(=O)OCC4=CC=CC=C4OC)[O-]

InChI

InChI=1S/C20H18N4O5/c1-3-28-14-8-9-16-17(10-14)23-19(22-24(16)26)15(11-21-23)20(25)29-12-13-6-4-5-7-18(13)27-2/h4-11H,3,12H2,1-2H3