[4-(5-pentylpyridin-2-yl)phenyl] 2-fluoranyl-4-pentyl-benzoate

Systemtic Name: [4-(5-pentylpyridin-2-yl)phenyl] 2-fluoranyl-4-pentyl-benzoate Openeye Name: [4-(5-pentyl-2-pyridyl)phenyl] 2-fluoro-4-pentyl-benzoate CAS Name: 2-fluoro-4-pentylbenzoic acid [4-(5-pentyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyridin-2-yl)phenyl] 2-fluoro-4-pentylbenzoate Traditional Name: 4-amyl-2-fluoro-benzoic acid [4-(5-amyl-2-pyridyl)phenyl] ester Formula: C28H32FNO2 MolecularWeight: 433.557583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCCC)F

InChI

InChI=1S/C28H32FNO2/c1-3-5-7-9-21-11-17-25(26(29)19-21)28(31)32-24-15-13-23(14-16-24)27-18-12-22(20-30-27)10-8-6-4-2/h11-20H,3-10H2,1-2H3