5-(9-methylundecyl)-2-(4-octan-2-yloxyphenyl)pyrimidine

Systemtic Name: 5-(9-methylundecyl)-2-(4-octan-2-yloxyphenyl)pyrimidine Openeye Name: 2-[4-(1-methylheptoxy)phenyl]-5-(9-methylundecyl)pyrimidine CAS Name: 5-(9-methylundecyl)-2-(4-octan-2-yloxyphenyl)pyrimidine IUPAC Name: 5-(9-methylundecyl)-2-(4-octan-2-yloxyphenyl)pyrimidine Traditional Name: 2-[4-(1-methylheptoxy)phenyl]-5-(9-methylundecyl)pyrimidine Formula: C30H48N2O MolecularWeight: 452.71492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCCCCC(C)CC

Isomeric SMILES

CCCCCCC(C)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCCCCC(C)CC

InChI

InChI=1S/C30H48N2O/c1-5-7-8-14-17-26(4)33-29-21-19-28(20-22-29)30-31-23-27(24-32-30)18-15-12-10-9-11-13-16-25(3)6-2/h19-26H,5-18H2,1-4H3