Vitas-M small molecule compound
2-butyl-2-methyl-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-dioxane-4,6-dione
Catalog ID
STL070630
SMILES CCCCC1(C)OC(=O)/C(=C/c2cc3OCOc3cc2[N+](=O)[O-])/C(=O)O1
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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 C17H17NO8 MW 363.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO8/c1-3-4-5-17(2)25-15(19)11(16(20)26-17)6-10-7-13-14(24-9-23-13)8-12(10)18(21)22/h6-8H,3-5,9H2,1-2H3/b11-6-InChIKey
PLHAZWHZLVWQBH-WDZFZDKYSA-NSynonyms
425655-91-02butyl2methyl5((6nitro13benzodioxol5yl)methylidene)13dioxane46dione
2butyl2methyl5((6nitrobenzo(d)(13)dioxol5yl)methylene)13dioxane46dione
425655910
CCCCC1(C)OC(=O)C(=Cc2cc3OCOc3cc2(N+)(=O)(O))C(=O)O1
MFCD02799052
ZINC000001890667
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