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CAS 884497-55-6

:

3-[5-[(3-Methyl-5-oxo-4(5H)-isoxazolylidene)methyl]-2-furanyl]benzoic acid

Description:
3-[5-[(3-Methyl-5-oxo-4(5H)-isoxazolylidene)methyl]-2-furanyl]benzoic acid, with the CAS number 884497-55-6, is a complex organic compound characterized by its unique structural features. It contains a benzoic acid moiety, which contributes to its acidic properties, and a furan ring that adds to its aromatic character. The presence of an isoxazole ring, specifically a 3-methyl-5-oxo derivative, indicates potential biological activity, as isoxazoles are often associated with various pharmacological effects. The compound's structure suggests it may exhibit both hydrophilic and lipophilic characteristics, influencing its solubility and interaction with biological systems. Additionally, the presence of multiple functional groups may allow for diverse reactivity and potential applications in medicinal chemistry. Overall, this compound's intricate structure and functional diversity make it a subject of interest for further research, particularly in the fields of drug development and organic synthesis.
Formula:C16H11NO5
InChI:InChI=1S/C16H11NO5/c1-9-13(16(20)22-17-9)8-12-5-6-14(21-12)10-3-2-4-11(7-10)15(18)19/h2-8H,1H3,(H,18,19)
InChI key:InChIKey=LLGRSOQSFREAIM-UHFFFAOYSA-N
SMILES:C(C=1OC(=CC1)C2=CC(C(O)=O)=CC=C2)=C3C(C)=NOC3=O
Synonyms:
  • Benzoic acid, 3-[5-[(3-methyl-5-oxo-4(5H)-isoxazolylidene)methyl]-2-furanyl]-
  • 3-[5-[(3-Methyl-5-oxo-4(5H)-isoxazolylidene)methyl]-2-furanyl]benzoic acid
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