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CAS 173584-44-6

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Indeno[1,2-e][1,3,4]oxadiazine-4a(3H)-carboxylic acid, 7-chloro-2,5-dihydro-2-[[(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]amino]carbonyl]-, methyl ester, (4aS)-

Description:
Indeno[1,2-e][1,3,4]oxadiazine-4a(3H)-carboxylic acid, 7-chloro-2,5-dihydro-2-[[(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]amino]carbonyl]-, methyl ester, with CAS number 173584-44-6, is a complex organic compound characterized by its unique bicyclic structure that incorporates an indeno framework fused with an oxadiazine ring. This compound features multiple functional groups, including a carboxylic acid and an ester, which contribute to its reactivity and potential applications in medicinal chemistry. The presence of a chloro substituent and a trifluoromethoxy group enhances its lipophilicity and may influence its biological activity. The methyl ester form suggests that it may be involved in esterification reactions or serve as a prodrug. Overall, this compound's intricate structure and functional diversity make it a subject of interest for research in pharmaceuticals, particularly in the development of new therapeutic agents. Its specific properties, such as solubility and stability, would depend on the surrounding conditions and the presence of other chemical entities.
Formula:C22H17ClF3N3O7
InChI:InChI=1/C22H17ClF3N3O7/c1-33-18(30)21-10-12-9-13(23)3-8-16(12)17(21)27-28(11-35-21)19(31)29(20(32)34-2)14-4-6-15(7-5-14)36-22(24,25)26/h3-9H,10-11H2,1-2H3/t21-/m0/s1
InChI key:InChIKey=VBCVPMMZEGZULK-NRFANRHFSA-N
SMILES:C(OC)(=O)[C@@]12C(C=3C(C1)=CC(Cl)=CC3)=NN(C(N(C(OC)=O)C4=CC=C(OC(F)(F)F)C=C4)=O)CO2
Synonyms:
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  • Dpx-Kn 128
  • Dpx-Mp 062-381
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