5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine

Systemtic Name: 5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine Openeye Name: 5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine CAS Name: 5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine IUPAC Name: 5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine Traditional Name: 5-(6-methyloctyl)-2-(4-oct-7-enoxyphenyl)pyrimidine Formula: C27H40N2O MolecularWeight: 408.6193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCCC=C

Isomeric SMILES

CCC(C)CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCCC=C

InChI

InChI=1S/C27H40N2O/c1-4-6-7-8-9-13-20-30-26-18-16-25(17-19-26)27-28-21-24(22-29-27)15-12-10-11-14-23(3)5-2/h4,16-19,21-23H,1,5-15,20H2,2-3H3