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

Systemtic Name: (4-hexylphenyl) 4-(5-butylpyridin-2-yl)-2-fluoranyl-benzoate Openeye Name: (4-hexylphenyl) 4-(5-butyl-2-pyridyl)-2-fluoro-benzoate CAS Name: 4-(5-butyl-2-pyridinyl)-2-fluorobenzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 4-(5-butylpyridin-2-yl)-2-fluorobenzoate Traditional Name: 4-(5-butyl-2-pyridyl)-2-fluoro-benzoic acid (4-hexylphenyl) ester Formula: C28H32FNO2 MolecularWeight: 433.557583

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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)CCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C28H32FNO2/c1-3-5-7-8-10-21-11-15-24(16-12-21)32-28(31)25-17-14-23(19-26(25)29)27-18-13-22(20-30-27)9-6-4-2/h11-20H,3-10H2,1-2H3