5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine

Systemtic Name: 5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 5-[2-(8-methyldecoxy)ethyl]-2-(1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Formula: C38H58N2O MolecularWeight: 558.87992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)CCOCCCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3=NC=C(C=N3)CCOCCCCCCCC(C)CC

InChI

InChI=1S/C38H58N2O/c1-4-6-7-8-9-12-18-26-38(27-23-36(24-28-38)35-21-16-14-17-22-35)37-39-31-34(32-40-37)25-30-41-29-19-13-10-11-15-20-33(3)5-2/h14,16-17,21-24,27-28,31-33,36H,4-13,15,18-20,25-26,29-30H2,1-3H3