[4-(5-octylpyridin-2-yl)phenyl] 2-fluoranyl-4-hexyl-benzoate

Systemtic Name: [4-(5-octylpyridin-2-yl)phenyl] 2-fluoranyl-4-hexyl-benzoate Openeye Name: [4-(5-octyl-2-pyridyl)phenyl] 2-fluoro-4-hexyl-benzoate CAS Name: 2-fluoro-4-hexylbenzoic acid [4-(5-octyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-octylpyridin-2-yl)phenyl] 2-fluoro-4-hexylbenzoate Traditional Name: 2-fluoro-4-hexyl-benzoic acid [4-(5-octyl-2-pyridyl)phenyl] ester Formula: C32H40FNO2 MolecularWeight: 489.663903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CCCCCC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CCCCCC)F

InChI

InChI=1S/C32H40FNO2/c1-3-5-7-9-10-12-14-26-16-22-31(34-24-26)27-17-19-28(20-18-27)36-32(35)29-21-15-25(23-30(29)33)13-11-8-6-4-2/h15-24H,3-14H2,1-2H3