[2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] octanoate

Systemtic Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] octanoate Openeye Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] octanoate CAS Name: octanoic acid [2-[4-(1-oxoheptoxy)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] octanoate Traditional Name: caprylic acid [2-(4-enanthyloxyphenyl)pyrimidin-5-yl] ester Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O4/c1-3-5-7-9-11-13-24(29)31-22-18-26-25(27-19-22)20-14-16-21(17-15-20)30-23(28)12-10-8-6-4-2/h14-19H,3-13H2,1-2H3