5-[4-(2-fluoranyl-3-methyl-pentoxy)phenyl]-2-(4-octylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranyl-3-methyl-pentoxy)phenyl]-2-(4-octylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-3-methyl-pentoxy)phenyl]-2-(4-octylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-3-methylpentoxy)phenyl]-2-(4-octylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-3-methylpentoxy)phenyl]-2-(4-octylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-3-methyl-pentoxy)phenyl]-2-(4-octylphenyl)pyrimidine Formula: C30H39FN2O MolecularWeight: 462.641863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)CC)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)CC)F

InChI

InChI=1S/C30H39FN2O/c1-4-6-7-8-9-10-11-24-12-14-26(15-13-24)30-32-20-27(21-33-30)25-16-18-28(19-17-25)34-22-29(31)23(3)5-2/h12-21,23,29H,4-11,22H2,1-3H3