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

Systemtic Name: (4-hexylphenyl) 2-fluoranyl-4-(5-hexylpyridin-2-yl)benzoate Openeye Name: (4-hexylphenyl) 2-fluoro-4-(5-hexyl-2-pyridyl)benzoate CAS Name: 2-fluoro-4-(5-hexyl-2-pyridinyl)benzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 2-fluoro-4-(5-hexylpyridin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-hexyl-2-pyridyl)benzoic acid (4-hexylphenyl) ester Formula: C30H36FNO2 MolecularWeight: 461.610743

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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)CCCCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C30H36FNO2/c1-3-5-7-9-11-23-13-17-26(18-14-23)34-30(33)27-19-16-25(21-28(27)31)29-20-15-24(22-32-29)12-10-8-6-4-2/h13-22H,3-12H2,1-2H3