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

Systemtic Name: (4-cyanophenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: (4-cyanophenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(1,2,4-triazol-1-yl)nicotinic acid (4-cyanophenyl) ester Formula: C15H9N5O2 MolecularWeight: 291.26426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC(=O)C2=CN=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1C#N)OC(=O)C2=CN=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C15H9N5O2/c16-7-11-1-4-13(5-2-11)22-15(21)12-3-6-14(18-8-12)20-10-17-9-19-20/h1-6,8-10H