1-methyl-5-oxidanylidene-4-phenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: 1-methyl-5-oxidanylidene-4-phenyl-1,2,4-triazole-3-carboxylate Openeye Name: 1-methyl-5-oxo-4-phenyl-1,2,4-triazole-3-carboxylate CAS Name: 1-methyl-5-oxo-4-phenyl-1,2,4-triazole-3-carboxylate IUPAC Name: 1-methyl-5-oxo-4-phenyl-1,2,4-triazole-3-carboxylate Traditional Name: 5-keto-1-methyl-4-phenyl-1,2,4-triazole-3-carboxylate Formula: C10H8N3O3- MolecularWeight: 218.18882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)C(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CN1C(=O)N(C(=N1)C(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C10H9N3O3/c1-12-10(16)13(8(11-12)9(14)15)7-5-3-2-4-6-7/h2-6H,1H3,(H,14,15)/p-1