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5-(3-fluoranyl-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine

5-(3-fluoranyl-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine

Systemtic Name:5-(3-fluoranyl-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine
Openeye Name:5-(3-fluoro-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine
CAS Name:5-(3-fluoro-6-methylnonoxy)-2-(4-nonylphenyl)pyrimidine
IUPAC Name:5-(3-fluoro-6-methylnonoxy)-2-(4-nonylphenyl)pyrimidine
Traditional Name:5-(3-fluoro-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine
Formula: C29H45FN2O
MolecularWeight: 456.678803
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CCC(C)CCC)F


Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CCC(C)CCC)F


InChI

InChI=1S/C29H45FN2O/c1-4-6-7-8-9-10-11-13-25-15-17-26(18-16-25)29-31-22-28(23-32-29)33-21-20-27(30)19-14-24(3)12-5-2/h15-18,22-24,27H,4-14,19-21H2,1-3H3


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