[4-(5-hexoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate

Systemtic Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate Openeye Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate CAS Name: 3-butoxypropanoic acid [4-(5-hexoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate Traditional Name: 3-butoxypropionic acid [4-(5-hexoxypyrimidin-2-yl)phenyl] ester Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCCCC

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCCCC

InChI

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