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

Systemtic Name: [4-(5-nonylpyridin-2-yl)phenyl] 2-fluoranyl-4-octyl-benzoate Openeye Name: [4-(5-nonyl-2-pyridyl)phenyl] 2-fluoro-4-octyl-benzoate CAS Name: 2-fluoro-4-octylbenzoic acid [4-(5-nonyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-nonylpyridin-2-yl)phenyl] 2-fluoro-4-octylbenzoate Traditional Name: 2-fluoro-4-octyl-benzoic acid [4-(5-nonyl-2-pyridyl)phenyl] ester Formula: C35H46FNO2 MolecularWeight: 531.743643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CCCCCCCC)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CCCCCCCC)F

InChI

InChI=1S/C35H46FNO2/c1-3-5-7-9-11-13-15-17-29-19-25-34(37-27-29)30-20-22-31(23-21-30)39-35(38)32-24-18-28(26-33(32)36)16-14-12-10-8-6-4-2/h18-27H,3-17H2,1-2H3