2-[3-fluoranyl-4-(6-fluoranylheptyl)phenyl]-5-octoxy-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(6-fluoranylheptyl)phenyl]-5-octoxy-pyrimidine Openeye Name: 2-[3-fluoro-4-(6-fluoroheptyl)phenyl]-5-octoxy-pyrimidine CAS Name: 2-[3-fluoro-4-(6-fluoroheptyl)phenyl]-5-octoxypyrimidine IUPAC Name: 2-[3-fluoro-4-(6-fluoroheptyl)phenyl]-5-octoxypyrimidine Traditional Name: 2-[3-fluoro-4-(6-fluoroheptyl)phenyl]-5-octoxy-pyrimidine Formula: C25H36F2N2O MolecularWeight: 418.562946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC(=C(C=C2)CCCCCC(C)F)F

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC(=C(C=C2)CCCCCC(C)F)F

InChI

InChI=1S/C25H36F2N2O/c1-3-4-5-6-7-11-16-30-23-18-28-25(29-19-23)22-15-14-21(24(27)17-22)13-10-8-9-12-20(2)26/h14-15,17-20H,3-13,16H2,1-2H3