methyl 2-(4-nitrophenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylate

Systemtic Name: methyl 2-(4-nitrophenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylate Openeye Name: methyl 2-(4-nitrophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylate CAS Name: 2-(4-nitrophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-nitrophenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylate Traditional Name: 3-keto-2-(4-nitrophenyl)-1H-1,2,4-triazole-5-carboxylic acid methyl ester Formula: C10H8N4O5 MolecularWeight: 264.19432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=NC(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H8N4O5/c1-19-9(15)8-11-10(16)13(12-8)6-2-4-7(5-3-6)14(17)18/h2-5H,1H3,(H,11,12,16)