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5-[3,5-bis(fluoranyl)octoxy]-2-(4-dodecylphenyl)pyrimidine

5-[3,5-bis(fluoranyl)octoxy]-2-(4-dodecylphenyl)pyrimidine

Systemtic Name:5-[3,5-bis(fluoranyl)octoxy]-2-(4-dodecylphenyl)pyrimidine
Openeye Name:5-(3,5-difluorooctoxy)-2-(4-dodecylphenyl)pyrimidine
CAS Name:5-(3,5-difluorooctoxy)-2-(4-dodecylphenyl)pyrimidine
IUPAC Name:5-(3,5-difluorooctoxy)-2-(4-dodecylphenyl)pyrimidine
Traditional Name:5-(3,5-difluorooctoxy)-2-(4-laurylphenyl)pyrimidine
Formula: C30H46F2N2O
MolecularWeight: 488.695846
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CC(CCC)F)F


Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CC(CCC)F)F


InChI

InChI=1S/C30H46F2N2O/c1-3-5-6-7-8-9-10-11-12-13-15-25-16-18-26(19-17-25)30-33-23-29(24-34-30)35-21-20-28(32)22-27(31)14-4-2/h16-19,23-24,27-28H,3-15,20-22H2,1-2H3


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