[4-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] heptanoate

Systemtic Name: [4-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] heptanoate Openeye Name: [4-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] heptanoate CAS Name: heptanoic acid [4-[5-[octoxy(oxo)methoxy]-2-pyrimidinyl]phenyl] ester IUPAC Name: [4-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] heptanoate Traditional Name: enanthic acid [4-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] ester Formula: C26H36N2O5 MolecularWeight: 456.57444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCC

InChI

InChI=1S/C26H36N2O5/c1-3-5-7-9-10-12-18-31-26(30)33-23-19-27-25(28-20-23)21-14-16-22(17-15-21)32-24(29)13-11-8-6-4-2/h14-17,19-20H,3-13,18H2,1-2H3