2-[4-(2-fluoranyl-4-methyl-nonoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-4-methyl-nonoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-4-methyl-nonoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-fluoro-4-methylnonoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-fluoro-4-methylnonoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-fluoro-4-methyl-nonoxy)phenyl]-5-octyl-pyrimidine Formula: C28H43FN2O MolecularWeight: 442.652223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(C)CCCCC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(C)CCCCC)F

InChI

InChI=1S/C28H43FN2O/c1-4-6-8-9-10-12-14-24-20-30-28(31-21-24)25-15-17-27(18-16-25)32-22-26(29)19-23(3)13-11-7-5-2/h15-18,20-21,23,26H,4-14,19,22H2,1-3H3