methyl 3-[(E)-pyridin-3-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxylate

Systemtic Name: methyl 3-[(E)-pyridin-3-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxylate Openeye Name: methyl 3-[(E)-3-pyridylmethyleneamino]-1H-1,2,4-triazole-5-carboxylate CAS Name: 3-[(E)-3-pyridinylmethylideneamino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-pyridin-3-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxylate Traditional Name: 3-[(E)-3-pyridylmethyleneamino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester Formula: C10H9N5O2 MolecularWeight: 231.21076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=NN1)N=CC2=CN=CC=C2

Isomeric SMILES

COC(=O)C1=NC(=NN1)/N=C/C2=CN=CC=C2

InChI

InChI=1S/C10H9N5O2/c1-17-9(16)8-13-10(15-14-8)12-6-7-3-2-4-11-5-7/h2-6H,1H3,(H,13,14,15)/b12-6+