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

Systemtic Name: 5-[4-(2-fluoranyl-3-methyl-butoxy)phenyl]-2-(4-octylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-octylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-octylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-octylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-octylphenyl)pyrimidine Formula: C29H37FN2O MolecularWeight: 448.615283

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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)C)F

Isomeric SMILES

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

InChI

InChI=1S/C29H37FN2O/c1-4-5-6-7-8-9-10-23-11-13-25(14-12-23)29-31-19-26(20-32-29)24-15-17-27(18-16-24)33-21-28(30)22(2)3/h11-20,22,28H,4-10,21H2,1-3H3