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

Systemtic Name: 5-(2-fluoranyl-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine Openeye Name: 5-(2-fluoro-6-methyl-nonoxy)-2-(4-nonylphenyl)pyrimidine CAS Name: 5-(2-fluoro-6-methylnonoxy)-2-(4-nonylphenyl)pyrimidine IUPAC Name: 5-(2-fluoro-6-methylnonoxy)-2-(4-nonylphenyl)pyrimidine Traditional Name: 5-(2-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)OCC(CCCC(C)CCC)F

Isomeric SMILES

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

InChI

InChI=1S/C29H45FN2O/c1-4-6-7-8-9-10-11-15-25-17-19-26(20-18-25)29-31-21-28(22-32-29)33-23-27(30)16-12-14-24(3)13-5-2/h17-22,24,27H,4-16,23H2,1-3H3