(4-cyanophenyl) 3-fluoranyl-5-octyl-pyridine-2-carboxylate

Systemtic Name: (4-cyanophenyl) 3-fluoranyl-5-octyl-pyridine-2-carboxylate Openeye Name: (4-cyanophenyl) 3-fluoro-5-octyl-pyridine-2-carboxylate CAS Name: 3-fluoro-5-octyl-2-pyridinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-fluoro-5-octylpyridine-2-carboxylate Traditional Name: 3-fluoro-5-octyl-picolinic acid (4-cyanophenyl) ester Formula: C21H23FN2O2 MolecularWeight: 354.417923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)F

Isomeric SMILES

CCCCCCCCC1=CC(=C(N=C1)C(=O)OC2=CC=C(C=C2)C#N)F

InChI

InChI=1S/C21H23FN2O2/c1-2-3-4-5-6-7-8-17-13-19(22)20(24-15-17)21(25)26-18-11-9-16(14-23)10-12-18/h9-13,15H,2-8H2,1H3