(4-cyano-2-fluoranyl-phenyl)methyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: (4-cyano-2-fluoro-phenyl)methyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid (4-cyano-2-fluorophenyl)methyl ester IUPAC Name: (4-cyano-2-fluorophenyl)methyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(1,2,4-triazol-1-yl)nicotinic acid (4-cyano-2-fluoro-benzyl) ester Formula: C16H10FN5O2 MolecularWeight: 323.281303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10FN5O2/c17-14-5-11(6-18)1-2-13(14)8-24-16(23)12-3-4-15(20-7-12)22-10-19-9-21-22/h1-5,7,9-10H,8H2