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

Systemtic Name: [4-(5-heptylpyridin-2-yl)phenyl] 2-fluoranyl-4-octyl-benzoate Openeye Name: [4-(5-heptyl-2-pyridyl)phenyl] 2-fluoro-4-octyl-benzoate CAS Name: 2-fluoro-4-octylbenzoic acid [4-(5-heptyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-heptylpyridin-2-yl)phenyl] 2-fluoro-4-octylbenzoate Traditional Name: 2-fluoro-4-octyl-benzoic acid [4-(5-heptyl-2-pyridyl)phenyl] ester Formula: C33H42FNO2 MolecularWeight: 503.690483

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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)CCCCCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C33H42FNO2/c1-3-5-7-9-11-12-14-26-16-22-30(31(34)24-26)33(36)37-29-20-18-28(19-21-29)32-23-17-27(25-35-32)15-13-10-8-6-4-2/h16-25H,3-15H2,1-2H3