[4-(5-hexoxypyrimidin-2-yl)phenyl] 2-propylpentanoate

Systemtic Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Openeye Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [4-(5-hexoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [4-(5-hexoxypyrimidin-2-yl)phenyl] ester Formula: C24H34N2O3 MolecularWeight: 398.53836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

InChI

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