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

Systemtic Name: (4-butylphenyl) 2-fluoranyl-4-(5-hexylpyridin-2-yl)benzoate Openeye Name: (4-butylphenyl) 2-fluoro-4-(5-hexyl-2-pyridyl)benzoate CAS Name: 2-fluoro-4-(5-hexyl-2-pyridinyl)benzoic acid (4-butylphenyl) ester IUPAC Name: (4-butylphenyl) 2-fluoro-4-(5-hexylpyridin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-hexyl-2-pyridyl)benzoic acid (4-butylphenyl) ester Formula: C28H32FNO2 MolecularWeight: 433.557583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC)F

InChI

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