2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptyl-pyrimidine

Systemtic Name: 2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptyl-pyrimidine Openeye Name: 2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptyl-pyrimidine CAS Name: 2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptylpyrimidine IUPAC Name: 2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptylpyrimidine Traditional Name: 2-[2-ethyl-6-(4-hexylphenyl)phenyl]-4-heptyl-pyrimidine Formula: C31H42N2 MolecularWeight: 442.67858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC(=NC=C1)C2=C(C=CC=C2CC)C3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCC1=NC(=NC=C1)C2=C(C=CC=C2CC)C3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C31H42N2/c1-4-7-9-11-13-17-28-23-24-32-31(33-28)30-26(6-3)16-14-18-29(30)27-21-19-25(20-22-27)15-12-10-8-5-2/h14,16,18-24H,4-13,15,17H2,1-3H3