[4-(5-butylpyrimidin-2-yl)phenyl] 2-heptoxypropanoate

Systemtic Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-heptoxypropanoate Openeye Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-heptoxypropanoate CAS Name: 2-heptoxypropanoic acid [4-(5-butyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-heptoxypropanoate Traditional Name: 2-heptoxypropionic acid [4-(5-butylpyrimidin-2-yl)phenyl] ester Formula: C24H34N2O3 MolecularWeight: 398.53836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

Isomeric SMILES

CCCCCCCOC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

InChI

InChI=1S/C24H34N2O3/c1-4-6-8-9-10-16-28-19(3)24(27)29-22-14-12-21(13-15-22)23-25-17-20(18-26-23)11-7-5-2/h12-15,17-19H,4-11,16H2,1-3H3