[4-(5-nonylpyrimidin-2-yl)phenyl] pentaneperoxoate

Systemtic Name: [4-(5-nonylpyrimidin-2-yl)phenyl] pentaneperoxoate Openeye Name: [4-(5-nonylpyrimidin-2-yl)phenyl] pentaneperoxoate CAS Name: pentaneperoxoic acid [4-(5-nonyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-nonylpyrimidin-2-yl)phenyl] pentaneperoxoate Traditional Name: peroxyvaleric acid [4-(5-nonylpyrimidin-2-yl)phenyl] ester Formula: C24H34N2O3 MolecularWeight: 398.53836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OOC(=O)CCCC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OOC(=O)CCCC

InChI

InChI=1S/C24H34N2O3/c1-3-5-7-8-9-10-11-12-20-18-25-24(26-19-20)21-14-16-22(17-15-21)28-29-23(27)13-6-4-2/h14-19H,3-13H2,1-2H3