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

Systemtic Name: [4-(5-octylpyridin-2-yl)phenyl] 4-ethyl-2-fluoranyl-benzoate Openeye Name: [4-(5-octyl-2-pyridyl)phenyl] 4-ethyl-2-fluoro-benzoate CAS Name: 4-ethyl-2-fluorobenzoic acid [4-(5-octyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-octylpyridin-2-yl)phenyl] 4-ethyl-2-fluorobenzoate Traditional Name: 4-ethyl-2-fluoro-benzoic acid [4-(5-octyl-2-pyridyl)phenyl] ester Formula: C28H32FNO2 MolecularWeight: 433.557583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)CC)F

InChI

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