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

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-heptylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-heptylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Formula: C29H37FN2O MolecularWeight: 448.615283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C29H37FN2O/c1-4-5-6-7-8-9-23-10-12-25(13-11-23)29-31-19-26(20-32-29)24-14-16-28(17-15-24)33-21-27(30)18-22(2)3/h10-17,19-20,22,27H,4-9,18,21H2,1-3H3