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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O4/c1-4-6-8-14-26-17(3)22(25)28-19-11-9-18(10-12-19)21-23-15-20(16-24-21)27-13-7-5-2/h9-12,15-17H,4-8,13-14H2,1-3H3