Vitas-M small molecule compound
6-(6-bromo-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one
Catalog ID
STK402719
SMILES O=C1CCC(C(N1)c1cc2OCOc2cc1Br)[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 C12H11BrN2O5 MW 343.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11BrN2O5/c13-7-4-10-9(19-5-20-10)3-6(7)12-8(15(17)18)1-2-11(16)14-12/h3-4,8,12H,1-2,5H2,(H,14,16)InChIKey
PRJGMUUNRHWKBF-UHFFFAOYSA-NSynonyms
347330-02-3347330023
6(6BROMO(2HBENZO(D)13DIOXOLAN5YL))5NITROPIPERIDIN2ONE
6(6BROMO13BENZODIOXOL5YL)5NITRO2PIPERIDINONE
6(6bromo13benzodioxol5yl)5nitropiperidin2one
C1CC(=O)NC(C1(N+)(=O)(O))C2=CC3=C(C=C2Br)OCO3
InChI=1SC12H11BrN2O5c1374109(1952010)36(7)128(15(17)18)1211(16)1412h34812H125H2(H1416)
MFCD02188800
O=C1CCC(C(N1)c1cc2OCOc2cc1Br)(N+)(=O)(O)
ZINC000000112058
ZINC000000112069
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