5-(6-methyloctoxy)-4-(2-octylphenyl)pyrimidine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1C2=NC=NC=C2OCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1C2=NC=NC=C2OCCCCCC(C)CC

InChI

InChI=1S/C27H42N2O/c1-4-6-7-8-9-12-17-24-18-13-14-19-25(24)27-26(21-28-22-29-27)30-20-15-10-11-16-23(3)5-2/h13-14,18-19,21-23H,4-12,15-17,20H2,1-3H3