[4-(5-propoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate

Systemtic Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate Openeye Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate CAS Name: 3-heptoxypropanoic acid [4-(5-propoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate Traditional Name: 3-heptoxypropionic acid [4-(5-propoxypyrimidin-2-yl)phenyl] ester Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O4/c1-3-5-6-7-8-15-27-16-13-22(26)29-20-11-9-19(10-12-20)23-24-17-21(18-25-23)28-14-4-2/h9-12,17-18H,3-8,13-16H2,1-2H3