(4-cyano-3-fluoranyl-phenyl) 5-butylpyridine-2-carboxylate

Systemtic Name: (4-cyano-3-fluoranyl-phenyl) 5-butylpyridine-2-carboxylate Openeye Name: (4-cyano-3-fluoro-phenyl) 5-butylpyridine-2-carboxylate CAS Name: 5-butyl-2-pyridinecarboxylic acid (4-cyano-3-fluorophenyl) ester IUPAC Name: (4-cyano-3-fluorophenyl) 5-butylpyridine-2-carboxylate Traditional Name: 5-butylpicolinic acid (4-cyano-3-fluoro-phenyl) ester Formula: C17H15FN2O2 MolecularWeight: 298.311603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CCCCC1=CN=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C17H15FN2O2/c1-2-3-4-12-5-8-16(20-11-12)17(21)22-14-7-6-13(10-19)15(18)9-14/h5-9,11H,2-4H2,1H3