[4-(5-octylpyridin-2-yl)phenyl] 2-fluoranyl-4-octyl-benzoate

Systemtic Name: [4-(5-octylpyridin-2-yl)phenyl] 2-fluoranyl-4-octyl-benzoate Openeye Name: [4-(5-octyl-2-pyridyl)phenyl] 2-fluoro-4-octyl-benzoate CAS Name: 2-fluoro-4-octylbenzoic acid [4-(5-octyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-octylpyridin-2-yl)phenyl] 2-fluoro-4-octylbenzoate Traditional Name: 2-fluoro-4-octyl-benzoic acid [4-(5-octyl-2-pyridyl)phenyl] ester Formula: C34H44FNO2 MolecularWeight: 517.717063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCCCCCC)F

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCCCCCC)F

InChI

InChI=1S/C34H44FNO2/c1-3-5-7-9-11-13-15-27-17-23-31(32(35)25-27)34(37)38-30-21-19-29(20-22-30)33-24-18-28(26-36-33)16-14-12-10-8-6-4-2/h17-26H,3-16H2,1-2H3