2-[4-(2-fluoranyl-3-methyl-heptoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-3-methyl-heptoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-3-methyl-heptoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-fluoro-3-methylheptoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-fluoro-3-methylheptoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-fluoro-3-methyl-heptoxy)phenyl]-5-octyl-pyrimidine Formula: C26H39FN2O MolecularWeight: 414.599063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H39FN2O/c1-4-6-8-9-10-11-13-22-18-28-26(29-19-22)23-14-16-24(17-15-23)30-20-25(27)21(3)12-7-5-2/h14-19,21,25H,4-13,20H2,1-3H3