5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine

Systemtic Name: 5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine Openeye Name: 5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine CAS Name: 5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine IUPAC Name: 5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine Traditional Name: 5-(5-methyloctoxy)-4-(2-octylphenyl)pyrimidine Formula: C27H42N2O MolecularWeight: 410.63518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1C2=NC=NC=C2OCCCCC(C)CCC

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1C2=NC=NC=C2OCCCCC(C)CCC

InChI

InChI=1S/C27H42N2O/c1-4-6-7-8-9-10-17-24-18-11-12-19-25(24)27-26(21-28-22-29-27)30-20-14-13-16-23(3)15-5-2/h11-12,18-19,21-23H,4-10,13-17,20H2,1-3H3