hexyl 5-fluoranylpyridine-3-carboxylate

Systemtic Name: hexyl 5-fluoranylpyridine-3-carboxylate Openeye Name: hexyl 5-fluoropyridine-3-carboxylate CAS Name: 5-fluoro-3-pyridinecarboxylic acid hexyl ester IUPAC Name: hexyl 5-fluoropyridine-3-carboxylate Traditional Name: 5-fluoronicotinic acid hexyl ester Formula: C12H16FNO2 MolecularWeight: 225.259343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=CN=C1)F

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=CN=C1)F

InChI

InChI=1S/C12H16FNO2/c1-2-3-4-5-6-16-12(15)10-7-11(13)9-14-8-10/h7-9H,2-6H2,1H3