1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl 3-methoxypropanoate

Systemtic Name: 1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl 3-methoxypropanoate Openeye Name: [1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenoxy]ethyl] 3-methoxypropanoate CAS Name: 3-methoxypropanoic acid 1-[4-(5-octoxy-2-pyrimidinyl)phenoxy]propan-2-yl ester IUPAC Name: 1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl 3-methoxypropanoate Traditional Name: 3-methoxypropionic acid [1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenoxy]ethyl] ester Formula: C25H36N2O5 MolecularWeight: 444.56374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCOC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCOC

InChI

InChI=1S/C25H36N2O5/c1-4-5-6-7-8-9-15-30-23-17-26-25(27-18-23)21-10-12-22(13-11-21)31-19-20(2)32-24(28)14-16-29-3/h10-13,17-18,20H,4-9,14-16,19H2,1-3H3