2-[4-(2-fluoranyl-4-hexyl-phenyl)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-4-hexyl-phenyl)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-4-hexyl-phenyl)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-fluoro-4-hexylphenyl)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-fluoro-4-hexylphenyl)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-fluoro-4-hexyl-phenyl)phenyl]-5-octyl-pyrimidine Formula: C30H39FN2 MolecularWeight: 446.642463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H39FN2/c1-3-5-7-9-10-12-14-25-22-32-30(33-23-25)27-18-16-26(17-19-27)28-20-15-24(21-29(28)31)13-11-8-6-4-2/h15-23H,3-14H2,1-2H3