5-[4-(2-fluoranyloctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranyloctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine CAS Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Formula: C30H39FN2O MolecularWeight: 462.641863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CCCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CCCCCC)F

InChI

InChI=1S/C30H39FN2O/c1-3-5-7-9-11-24-13-15-26(16-14-24)30-32-21-27(22-33-30)25-17-19-29(20-18-25)34-23-28(31)12-10-8-6-4-2/h13-22,28H,3-12,23H2,1-2H3