CAS 887354-95-2

1,3-Diethyl 2-(acetylamino)-2-[[3-(2-ethoxy-2-oxoethoxy)-5-methyl-4-isoxazolyl]methyl]propanedioate

Description:

1,3-Diethyl 2-(acetylamino)-2-[[3-(2-ethoxy-2-oxoethoxy)-5-methyl-4-isoxazolyl]methyl]propanedioate, with CAS number 887354-95-2, is a complex organic compound characterized by its multi-functional structure. It features a propanedioate backbone, which is a diester, indicating the presence of two ethyl groups attached to the central carbon. The compound also contains an acetylamino group, contributing to its potential biological activity. The isoxazole ring, a five-membered heterocyclic structure containing nitrogen and oxygen, is known for its role in various pharmacological applications. The ethoxy and oxoethoxy substituents enhance the compound's solubility and reactivity. This substance may exhibit properties such as moderate to high polarity, depending on the functional groups present, and could be of interest in medicinal chemistry for its potential therapeutic effects. Its synthesis and applications would likely be explored in the context of drug development or as a chemical intermediate in organic synthesis. However, specific data regarding its physical properties, reactivity, and safety profile would require further investigation in scientific literature.

Formula: C₁₈H₂₆N₂O₉

InChI: InChI=1S/C18H26N2O9/c1-6-25-14(22)10-28-15-13(11(4)29-20-15)9-18(19-12(5)21,16(23)26-7-2)17(24)27-8-3/h6-10H2,1-5H3,(H,19,21)

InChI key: InChIKey=MPWVMWLHAIVUDE-UHFFFAOYSA-N

SMILES: C(CC=1C(OCC(OCC)=O)=NOC1C)(C(OCC)=O)(C(OCC)=O)NC(C)=O

Synonyms:

• 1,3-Diethyl 2-(acetylamino)-2-[[3-(2-ethoxy-2-oxoethoxy)-5-methyl-4-isoxazolyl]methyl]propanedioate
• Propanedioic acid, 2-(acetylamino)-2-[[3-(2-ethoxy-2-oxoethoxy)-5-methyl-4-isoxazolyl]methyl]-, 1,3-diethyl ester
• Propanedioic acid, (acetylamino)[[3-(2-ethoxy-2-oxoethoxy)-5-methyl-4-isoxazolyl]methyl]-, diethyl ester