2-[4-(3-fluoranyl-4-methyl-octoxy)phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[4-(3-fluoranyl-4-methyl-octoxy)phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[4-(3-fluoro-4-methyl-octoxy)phenyl]-5-nonyl-pyrimidine CAS Name: 2-[4-(3-fluoro-4-methyloctoxy)phenyl]-5-nonylpyrimidine IUPAC Name: 2-[4-(3-fluoro-4-methyloctoxy)phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-(3-fluoro-4-methyl-octoxy)phenyl]-5-nonyl-pyrimidine Formula: C28H43FN2O MolecularWeight: 442.652223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CCCC)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CCCC)F

InChI

InChI=1S/C28H43FN2O/c1-4-6-8-9-10-11-12-14-24-21-30-28(31-22-24)25-15-17-26(18-16-25)32-20-19-27(29)23(3)13-7-5-2/h15-18,21-23,27H,4-14,19-20H2,1-3H3