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

Systemtic Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Openeye Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [4-(5-butoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [4-(5-butoxypyrimidin-2-yl)phenyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

Isomeric SMILES

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

InChI

InChI=1S/C22H30N2O3/c1-4-7-14-26-20-15-23-21(24-16-20)17-10-12-19(13-11-17)27-22(25)18(8-5-2)9-6-3/h10-13,15-16,18H,4-9,14H2,1-3H3