(4-hexylphenyl) 2-fluoranyl-4-(5-pentylpyridin-2-yl)benzoate

Systemtic Name: (4-hexylphenyl) 2-fluoranyl-4-(5-pentylpyridin-2-yl)benzoate Openeye Name: (4-hexylphenyl) 2-fluoro-4-(5-pentyl-2-pyridyl)benzoate CAS Name: 2-fluoro-4-(5-pentyl-2-pyridinyl)benzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 2-fluoro-4-(5-pentylpyridin-2-yl)benzoate Traditional Name: 4-(5-amyl-2-pyridyl)-2-fluoro-benzoic acid (4-hexylphenyl) ester Formula: C29H34FNO2 MolecularWeight: 447.584163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=C3)CCCCC)F

InChI

InChI=1S/C29H34FNO2/c1-3-5-7-9-10-22-12-16-25(17-13-22)33-29(32)26-18-15-24(20-27(26)30)28-19-14-23(21-31-28)11-8-6-4-2/h12-21H,3-11H2,1-2H3