[2-(4-dodecoxyphenyl)pyrimidin-5-yl] decanoate

Systemtic Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] decanoate Openeye Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] decanoate CAS Name: decanoic acid [2-(4-dodecoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] decanoate Traditional Name: capric acid [2-(4-lauryloxyphenyl)pyrimidin-5-yl] ester Formula: C32H50N2O3 MolecularWeight: 510.751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCCC

InChI

InChI=1S/C32H50N2O3/c1-3-5-7-9-11-12-13-15-17-19-25-36-29-23-21-28(22-24-29)32-33-26-30(27-34-32)37-31(35)20-18-16-14-10-8-6-4-2/h21-24,26-27H,3-20,25H2,1-2H3