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5-(3-fluoranyl-5-methyl-octoxy)-2-(4-undecylphenyl)pyrimidine

5-(3-fluoranyl-5-methyl-octoxy)-2-(4-undecylphenyl)pyrimidine

Systemtic Name:5-(3-fluoranyl-5-methyl-octoxy)-2-(4-undecylphenyl)pyrimidine
Openeye Name:5-(3-fluoro-5-methyl-octoxy)-2-(4-undecylphenyl)pyrimidine
CAS Name:5-(3-fluoro-5-methyloctoxy)-2-(4-undecylphenyl)pyrimidine
IUPAC Name:5-(3-fluoro-5-methyloctoxy)-2-(4-undecylphenyl)pyrimidine
Traditional Name:5-(3-fluoro-5-methyl-octoxy)-2-(4-undecylphenyl)pyrimidine
Formula: C30H47FN2O
MolecularWeight: 470.705383
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CC(C)CCC)F


Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CC(C)CCC)F


InChI

InChI=1S/C30H47FN2O/c1-4-6-7-8-9-10-11-12-13-15-26-16-18-27(19-17-26)30-32-23-29(24-33-30)34-21-20-28(31)22-25(3)14-5-2/h16-19,23-25,28H,4-15,20-22H2,1-3H3


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