[4-(5-hexoxypyrimidin-2-yl)phenyl] 2-hexoxypropanoate

Systemtic Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-hexoxypropanoate Openeye Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-hexoxypropanoate CAS Name: 2-hexoxypropanoic acid [4-(5-hexoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 2-hexoxypropanoate Traditional Name: 2-hexoxypropionic acid [4-(5-hexoxypyrimidin-2-yl)phenyl] ester Formula: C25H36N2O4 MolecularWeight: 428.56434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O4/c1-4-6-8-10-16-29-20(3)25(28)31-22-14-12-21(13-15-22)24-26-18-23(19-27-24)30-17-11-9-7-5-2/h12-15,18-20H,4-11,16-17H2,1-3H3