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

Systemtic Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate Openeye Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate CAS Name: 2-pentoxypropanoic acid [4-(5-propoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate Traditional Name: 2-amoxypropionic acid [4-(5-propoxypyrimidin-2-yl)phenyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O4/c1-4-6-7-13-25-16(3)21(24)27-18-10-8-17(9-11-18)20-22-14-19(15-23-20)26-12-5-2/h8-11,14-16H,4-7,12-13H2,1-3H3