[4-(5-propylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate

Systemtic Name: [4-(5-propylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate Openeye Name: [4-(5-propylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate CAS Name: 3-hexoxypropanoic acid [4-(5-propyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate Traditional Name: 3-hexoxypropionic acid [4-(5-propylpyrimidin-2-yl)phenyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-3-5-6-7-14-26-15-13-21(25)27-20-11-9-19(10-12-20)22-23-16-18(8-4-2)17-24-22/h9-12,16-17H,3-8,13-15H2,1-2H3