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

Systemtic Name: (4-hexylphenyl) 2-fluoranyl-4-(5-propylpyridin-2-yl)benzoate Openeye Name: (4-hexylphenyl) 2-fluoro-4-(5-propyl-2-pyridyl)benzoate CAS Name: 2-fluoro-4-(5-propyl-2-pyridinyl)benzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 2-fluoro-4-(5-propylpyridin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-propyl-2-pyridyl)benzoic acid (4-hexylphenyl) ester Formula: C27H30FNO2 MolecularWeight: 419.531003

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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)CCC)F

Isomeric SMILES

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

InChI

InChI=1S/C27H30FNO2/c1-3-5-6-7-9-20-10-14-23(15-11-20)31-27(30)24-16-13-22(18-25(24)28)26-17-12-21(8-4-2)19-29-26/h10-19H,3-9H2,1-2H3