[4-(5-butoxypyrimidin-2-yl)phenyl] 3-pentoxypropanoate

Systemtic Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 3-pentoxypropanoate Openeye Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 3-pentoxypropanoate CAS Name: 3-pentoxypropanoic acid [4-(5-butoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 3-pentoxypropanoate Traditional Name: 3-amoxypropionic acid [4-(5-butoxypyrimidin-2-yl)phenyl] ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

Isomeric SMILES

CCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

InChI

InChI=1S/C22H30N2O4/c1-3-5-7-13-26-15-12-21(25)28-19-10-8-18(9-11-19)22-23-16-20(17-24-22)27-14-6-4-2/h8-11,16-17H,3-7,12-15H2,1-2H3