2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine

Systemtic Name: 2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine Openeye Name: 2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine CAS Name: 2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine IUPAC Name: 2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine Traditional Name: 2-(6-methyloctyl)-5-(4-octoxyphenyl)pyrimidine Formula: C27H42N2O MolecularWeight: 410.63518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)CCCCCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)CCCCCC(C)CC

InChI

InChI=1S/C27H42N2O/c1-4-6-7-8-9-13-20-30-26-18-16-24(17-19-26)25-21-28-27(29-22-25)15-12-10-11-14-23(3)5-2/h16-19,21-23H,4-15,20H2,1-3H3