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

Systemtic Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Openeye Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [4-(5-propoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [4-(5-propoxypyrimidin-2-yl)phenyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3/c1-4-7-17(8-5-2)21(24)26-18-11-9-16(10-12-18)20-22-14-19(15-23-20)25-13-6-3/h9-12,14-15,17H,4-8,13H2,1-3H3