IN-KG 433

Analyte Name

Indoxacarb metabolite 2 IN-KG 433

CAS Number

177905-09-8

Molecular Formula

C21 H17 Cl F3 N3 O7

Molecular Weight

515.82

Accurate Mass

515.0707

SMILES

COC(=O)N(C(=O)N\N=C/1\c2ccc(Cl)cc2CC1(O)C(=O)OC)c3ccc(OC(F)(F)F)cc3

InChI

InChI=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-

IUPAC

methyl (3Z)-6-chloro-2-hydroxy-3-[[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]hydrazinylidene]-1H-indene-2-carboxylate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)