Vitas-M small molecule compound
(1E)-1-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitropropan-1-imine
Catalog ID
STK692552
SMILES O/N=C(\c1cc2OCOc2c(c1OC)OC)/C([N+](=O)[O-])C
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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 C12H14N2O7 MW 298.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O7/c1-6(14(16)17)9(13-15)7-4-8-11(21-5-20-8)12(19-3)10(7)18-2/h4,6,15H,5H2,1-3H3/b13-9-InChIKey
JMOZPNCDPGTBQG-LCYFTJDESA-NSynonyms
(1E)1(67dimethoxy13benzodioxol5yl)Nhydroxy2nitropropan1imine
(NE)N(1(67dimethoxy13benzodioxol5yl)2nitropropylidene)hydroxylamine
CC(C(=NO)C1=CC2=C(C(=C1OC)OC)OCO2)(N+)(=O)(O)
InChI=1SC12H14N2O7c16(14(16)17)9(1315)74811(215208)12(193)10(7)182h4615H5H213H3b139
MFCD10038565
ON=C(c1cc2OCOc2c(c1OC)OC)C((N+)(=O)(O))C
ZINC000015084025
ZINC000015084027
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