[4-[5-(2-methylbutoxy)pyrimidin-2-yl]phenyl] undecanoate

Systemtic Name: [4-[5-(2-methylbutoxy)pyrimidin-2-yl]phenyl] undecanoate Openeye Name: [4-[5-(2-methylbutoxy)pyrimidin-2-yl]phenyl] undecanoate CAS Name: undecanoic acid [4-[5-(2-methylbutoxy)-2-pyrimidinyl]phenyl] ester IUPAC Name: [4-[5-(2-methylbutoxy)pyrimidin-2-yl]phenyl] undecanoate Traditional Name: undecanoic acid [4-[5-(2-methylbutoxy)pyrimidin-2-yl]phenyl] ester Formula: C26H38N2O3 MolecularWeight: 426.59152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(C)CC

InChI

InChI=1S/C26H38N2O3/c1-4-6-7-8-9-10-11-12-13-25(29)31-23-16-14-22(15-17-23)26-27-18-24(19-28-26)30-20-21(3)5-2/h14-19,21H,4-13,20H2,1-3H3