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2-[3-fluoranyl-4-(3-fluoranyloctoxy)phenyl]-5-undecyl-pyrimidine

2-[3-fluoranyl-4-(3-fluoranyloctoxy)phenyl]-5-undecyl-pyrimidine

Systemtic Name:2-[3-fluoranyl-4-(3-fluoranyloctoxy)phenyl]-5-undecyl-pyrimidine
Openeye Name:2-[3-fluoro-4-(3-fluorooctoxy)phenyl]-5-undecyl-pyrimidine
CAS Name:2-[3-fluoro-4-(3-fluorooctoxy)phenyl]-5-undecylpyrimidine
IUPAC Name:2-[3-fluoro-4-(3-fluorooctoxy)phenyl]-5-undecylpyrimidine
Traditional Name:2-[3-fluoro-4-(3-fluorooctoxy)phenyl]-5-undecyl-pyrimidine
Formula: C29H44F2N2O
MolecularWeight: 474.669266
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CCCCC)F)F


Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(CCCCC)F)F


InChI

InChI=1S/C29H44F2N2O/c1-3-5-7-8-9-10-11-12-14-15-24-22-32-29(33-23-24)25-17-18-28(27(31)21-25)34-20-19-26(30)16-13-6-4-2/h17-18,21-23,26H,3-16,19-20H2,1-2H3


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