2-(2-fluoranyl-4-octoxy-phenyl)-5-(4-octylphenyl)pyrimidine

Systemtic Name: 2-(2-fluoranyl-4-octoxy-phenyl)-5-(4-octylphenyl)pyrimidine Openeye Name: 2-(2-fluoro-4-octoxy-phenyl)-5-(4-octylphenyl)pyrimidine CAS Name: 2-(2-fluoro-4-octoxyphenyl)-5-(4-octylphenyl)pyrimidine IUPAC Name: 2-(2-fluoro-4-octoxyphenyl)-5-(4-octylphenyl)pyrimidine Traditional Name: 2-(2-fluoro-4-octoxy-phenyl)-5-(4-octylphenyl)pyrimidine Formula: C32H43FN2O MolecularWeight: 490.695023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=C(C=C(C=C3)OCCCCCCCC)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=C(C=C(C=C3)OCCCCCCCC)F

InChI

InChI=1S/C32H43FN2O/c1-3-5-7-9-11-13-15-26-16-18-27(19-17-26)28-24-34-32(35-25-28)30-21-20-29(23-31(30)33)36-22-14-12-10-8-6-4-2/h16-21,23-25H,3-15,22H2,1-2H3