2-[3-fluoranyl-4-(3-fluoranylheptoxy)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(3-fluoranylheptoxy)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(3-fluoroheptoxy)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[3-fluoro-4-(3-fluoroheptoxy)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[3-fluoro-4-(3-fluoroheptoxy)phenyl]-5-hexylpyrimidine Traditional Name: 2-[3-fluoro-4-(3-fluoroheptoxy)phenyl]-5-hexyl-pyrimidine Formula: C23H32F2N2O MolecularWeight: 390.509786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CCCC)F)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CCCC)F)F

InChI

InChI=1S/C23H32F2N2O/c1-3-5-7-8-9-18-16-26-23(27-17-18)19-11-12-22(21(25)15-19)28-14-13-20(24)10-6-4-2/h11-12,15-17,20H,3-10,13-14H2,1-2H3