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

Systemtic Name: 2-[3-fluoranyl-4-(3-fluoranylbutoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-octyl-pyrimidine Formula: C22H30F2N2O MolecularWeight: 376.483206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

InChI

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