4-[4-(5-octoxypyrimidin-2-yl)phenoxy]butan-2-yl butanoate

Systemtic Name: 4-[4-(5-octoxypyrimidin-2-yl)phenoxy]butan-2-yl butanoate Openeye Name: [1-methyl-3-[4-(5-octoxypyrimidin-2-yl)phenoxy]propyl] butanoate CAS Name: butanoic acid 4-[4-(5-octoxy-2-pyrimidinyl)phenoxy]butan-2-yl ester IUPAC Name: 4-[4-(5-octoxypyrimidin-2-yl)phenoxy]butan-2-yl butanoate Traditional Name: butyric acid [1-methyl-3-[4-(5-octoxypyrimidin-2-yl)phenoxy]propyl] ester Formula: C26H38N2O4 MolecularWeight: 442.59092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)OC(=O)CCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)OC(=O)CCC

InChI

InChI=1S/C26H38N2O4/c1-4-6-7-8-9-10-17-30-24-19-27-26(28-20-24)22-12-14-23(15-13-22)31-18-16-21(3)32-25(29)11-5-2/h12-15,19-21H,4-11,16-18H2,1-3H3