(4-propylphenyl) 2-fluoranyl-4-(5-octylpyridin-2-yl)benzoate

Systemtic Name: (4-propylphenyl) 2-fluoranyl-4-(5-octylpyridin-2-yl)benzoate Openeye Name: (4-propylphenyl) 2-fluoro-4-(5-octyl-2-pyridyl)benzoate CAS Name: 2-fluoro-4-(5-octyl-2-pyridinyl)benzoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 2-fluoro-4-(5-octylpyridin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-octyl-2-pyridyl)benzoic acid (4-propylphenyl) ester Formula: C29H34FNO2 MolecularWeight: 447.584163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F

InChI

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