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

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-nonylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-nonylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-nonylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-nonylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-nonylphenyl)pyrimidine Formula: C31H41FN2O MolecularWeight: 476.668443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C31H41FN2O/c1-4-5-6-7-8-9-10-11-25-12-14-27(15-13-25)31-33-21-28(22-34-31)26-16-18-30(19-17-26)35-23-29(32)20-24(2)3/h12-19,21-22,24,29H,4-11,20,23H2,1-3H3