[4-(5-butylpyridin-2-yl)phenyl] 4-butyl-2-fluoranyl-benzoate

Systemtic Name: [4-(5-butylpyridin-2-yl)phenyl] 4-butyl-2-fluoranyl-benzoate Openeye Name: [4-(5-butyl-2-pyridyl)phenyl] 4-butyl-2-fluoro-benzoate CAS Name: 4-butyl-2-fluorobenzoic acid [4-(5-butyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-butylpyridin-2-yl)phenyl] 4-butyl-2-fluorobenzoate Traditional Name: 4-butyl-2-fluoro-benzoic acid [4-(5-butyl-2-pyridyl)phenyl] ester Formula: C26H28FNO2 MolecularWeight: 405.504423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCCC)F

InChI

InChI=1S/C26H28FNO2/c1-3-5-7-19-9-15-23(24(27)17-19)26(29)30-22-13-11-21(12-14-22)25-16-10-20(18-28-25)8-6-4-2/h9-18H,3-8H2,1-2H3