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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCCCC(C)CCC

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCCCC(C)CCC

InChI

InChI=1S/C27H42N2O/c1-4-6-7-8-9-14-20-30-26-19-13-12-18-25(26)27-24(21-28-22-29-27)17-11-10-16-23(3)15-5-2/h12-13,18-19,21-23H,4-11,14-17,20H2,1-3H3