(4-methylphenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: (4-methylphenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: p-tolyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(1,2,4-triazol-1-yl)nicotinic acid p-tolyl ester Formula: C15H12N4O2 MolecularWeight: 280.28138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C15H12N4O2/c1-11-2-5-13(6-3-11)21-15(20)12-4-7-14(17-8-12)19-10-16-9-18-19/h2-10H,1H3