2-[4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine Traditional Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine Formula: C29H38N2 MolecularWeight: 414.62542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCC

InChI

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