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Indoxacarb metabolite 2 IN-KG 433

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For Research Use Only | Not For Clinical Use
CATAPS177905098
CAS177905-09-8
SynonymsIN-KG 433,1H-Indene-2-carboxylic acid, 5-chloro-2,3-dihydro-2-hydroxy-1-[2-[[(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]amino]carbonyl]hydrazinylidene]-, methyl ester, 1H-Indene-2-carboxylic acid, 5-chloro-2,3-dihydro-2-hydroxy-1-[[[(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]amino]carbonyl]hydrazono]-, methyl ester (9CI)
IUPAC Namemethyl (3Z)-6-chloro-2-hydroxy-3-[[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]hydrazinylidene]-1H-indene-2-carboxylate
Molecular Weight515.82
Molecular FormulaC21H17ClF3N3O7
Canonical SMILESCOC(=O)N(C(=O)N\N=C/1\c2ccc(Cl)cc2CC1(O)C(=O)OC)c3ccc(OC(F)(F)F)cc3
InChIInChI=1S/C21H17ClF3N3O7/c1-33-17(29)20(32)10-11-9-12(22)3-8-15(11)16(20)26-27-18(30)28(19(31)34-2)13-4-6-14(7-5-13)35-21(23,24)25/h3-9,32H,10H2,1-2H3,(H,27,30)/b26-16-
Accurate Mass515.0707
FormatNeat
SubcategoryInsecticides and metabolites
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