methyl 4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazole-3-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazole-3-carboxylate Openeye Name: methyl 4-(p-tolyl)-5-(2-pyridyl)-1,2,4-triazole-3-carboxylate CAS Name: 4-(4-methylphenyl)-5-(2-pyridinyl)-1,2,4-triazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazole-3-carboxylate Traditional Name: 4-(p-tolyl)-5-(2-pyridyl)-1,2,4-triazole-3-carboxylic acid methyl ester Formula: C16H14N4O2 MolecularWeight: 294.30796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2C(=O)OC)C3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2C(=O)OC)C3=CC=CC=N3

InChI

InChI=1S/C16H14N4O2/c1-11-6-8-12(9-7-11)20-14(13-5-3-4-10-17-13)18-19-15(20)16(21)22-2/h3-10H,1-2H3