2-[3-fluoranyl-4-(3-fluoranylpentoxy)phenyl]-5-heptyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(3-fluoranylpentoxy)phenyl]-5-heptyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(3-fluoropentoxy)phenyl]-5-heptyl-pyrimidine CAS Name: 2-[3-fluoro-4-(3-fluoropentoxy)phenyl]-5-heptylpyrimidine IUPAC Name: 2-[3-fluoro-4-(3-fluoropentoxy)phenyl]-5-heptylpyrimidine Traditional Name: 2-[3-fluoro-4-(3-fluoropentoxy)phenyl]-5-heptyl-pyrimidine Formula: C22H30F2N2O MolecularWeight: 376.483206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CC)F)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CC)F)F

InChI

InChI=1S/C22H30F2N2O/c1-3-5-6-7-8-9-17-15-25-22(26-16-17)18-10-11-21(20(24)14-18)27-13-12-19(23)4-2/h10-11,14-16,19H,3-9,12-13H2,1-2H3