CAS 170917-89-2

4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate

Description:

4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate is a complex organic compound characterized by its unique indeno-oxadiazine structure, which incorporates both a chloro substituent and a dicarboxylate functional group. This compound features a fused ring system that contributes to its stability and potential reactivity. The presence of the phenylmethyl group enhances its lipophilicity, which may influence its solubility and interaction with biological systems. The chloro group can serve as a site for further chemical modifications, making it a versatile intermediate in synthetic chemistry. Additionally, the dicarboxylate moiety may impart acidic properties, allowing for potential applications in pharmaceuticals or agrochemicals. Overall, the structural complexity and functional groups present in this compound suggest it may exhibit interesting biological activities, warranting further investigation in medicinal chemistry and related fields.

Formula: C₂₀H₁₇ClN₂O₅

InChI: InChI=1S/C20H17ClN2O5/c1-26-18(24)20-10-14-9-15(21)7-8-16(14)17(20)22-23(12-28-20)19(25)27-11-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3

InChI key: InChIKey=YFVYPTZIEXOAIT-UHFFFAOYSA-N

SMILES: C(OC)(=O)C12C(C=3C(C1)=CC(Cl)=CC3)=NN(C(OCC4=CC=CC=C4)=O)CO2

Synonyms:

• 4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate
• 7-Chloro-5H-indeno[1,2-e][1,3,4]oxadiazine-2,4a-dicarboxylic acid 2-benzyl ester 4a-Methyl ester
• 7-Chloroindeno[1,2-E][1,3,4]Oxadiazine-2,4A(3H,5H)-Dicarboxylic Acid 4A-Methyl 2-Benzyl Ester
• Indeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylic acid, 7-chloro-, 4a-methyl 2-(phenylmethyl) ester

Indoxacarb Impurity 7

CAS: 170917-89-2

Formula: C₂₀H₁₇ClN₂O₅

Molecular weight: 400.82

Ref: 4Z-I-066009