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

Systemtic Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] undecanoate Openeye Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] undecanoate CAS Name: undecanoic acid [2-[4-(4-pentylcyclohexyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] undecanoate Traditional Name: undecanoic acid [2-[4-(4-amylcyclohexyl)phenyl]pyrimidin-5-yl] ester Formula: C32H48N2O2 MolecularWeight: 492.73572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

InChI

InChI=1S/C32H48N2O2/c1-3-5-7-8-9-10-11-13-15-31(35)36-30-24-33-32(34-25-30)29-22-20-28(21-23-29)27-18-16-26(17-19-27)14-12-6-4-2/h20-27H,3-19H2,1-2H3