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5-[2,4-bis(fluoranyl)hexoxy]-2-(4-undecylphenyl)pyrimidine

5-[2,4-bis(fluoranyl)hexoxy]-2-(4-undecylphenyl)pyrimidine

Systemtic Name:5-[2,4-bis(fluoranyl)hexoxy]-2-(4-undecylphenyl)pyrimidine
Openeye Name:5-(2,4-difluorohexoxy)-2-(4-undecylphenyl)pyrimidine
CAS Name:5-(2,4-difluorohexoxy)-2-(4-undecylphenyl)pyrimidine
IUPAC Name:5-(2,4-difluorohexoxy)-2-(4-undecylphenyl)pyrimidine
Traditional Name:5-(2,4-difluorohexoxy)-2-(4-undecylphenyl)pyrimidine
Formula: C27H40F2N2O
MolecularWeight: 446.616106
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CC(CC)F)F


Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CC(CC)F)F


InChI

InChI=1S/C27H40F2N2O/c1-3-5-6-7-8-9-10-11-12-13-22-14-16-23(17-15-22)27-30-19-26(20-31-27)32-21-25(29)18-24(28)4-2/h14-17,19-20,24-25H,3-13,18,21H2,1-2H3


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