[4-(5-octoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate CAS Name: 2-octoxypropanoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate Traditional Name: 2-octoxypropionic acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C29H44N2O4 MolecularWeight: 484.67066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCCCCC

InChI

InChI=1S/C29H44N2O4/c1-4-6-8-10-12-14-20-33-24(3)29(32)35-26-18-16-25(17-19-26)28-30-22-27(23-31-28)34-21-15-13-11-9-7-5-2/h16-19,22-24H,4-15,20-21H2,1-3H3