Vitas-M small molecule compound
2-{[(E)-(4,5-dimethoxy-2-nitrophenyl)methylidene]amino}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK061441
SMILES COc1cc(/C=N/N2C(=O)c3c(C2=O)cccc3)c(cc1OC)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H13N3O6 MW 355.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O6/c1-25-14-7-10(13(20(23)24)8-15(14)26-2)9-18-19-16(21)11-5-3-4-6-12(11)17(19)22/h3-9H,1-2H3/b18-9+InChIKey
CNHZVOIXPJPJEY-GIJQJNRQSA-NSynonyms
2(((E)(45DIMETHOXY2NITROPHENYL)METHYLIDENE)AMINO)1HISOINDOLE13(2H)DIONE
2((1E)2(45DIMETHOXY2NITROPHENYL)1AZAVINYL)BENZO(C)AZOLINE13DIONE
2((2NITRO45DIMETHOXYBENZYLIDENE)AMINO)1HISOINDOLE13(2H)DIONE
2((45DIMETHOXY2NITROBENZYLIDENE)AMINO)ISOINDOLE13DIONE
2((E)(45DIMETHOXY2NITROPHENYL)METHYLIDENEAMINO)ISOINDOLE13DIONE
COC1=C(C=C(C(=C1)C=NN2C(=O)C3=CC=CC=C3C2=O)(N+)(=O)(O))OC
COc1cc(C=NN2C(=O)c3c(C2=O)cccc3)c(cc1OC)(N+)(=O)(O)
InChI=1SC17H13N3O6c12514710(13(20(23)24)815(14)262)9181916(21)11534612(11)17(19)22h39H12H3b189+
MFCD00556372
STK061441
ZINC000000705245
ZINC33335772
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