5-octyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine

Systemtic Name: 5-octyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine Openeye Name: 5-octyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine CAS Name: 5-octyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine IUPAC Name: 5-octyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine Traditional Name: 2-[4-(4-amylphenyl)phenyl]-5-octyl-pyrimidine Formula: C29H38N2 MolecularWeight: 414.62542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C29H38N2/c1-3-5-7-8-9-11-13-25-22-30-29(31-23-25)28-20-18-27(19-21-28)26-16-14-24(15-17-26)12-10-6-4-2/h14-23H,3-13H2,1-2H3