Vitas-M small molecule compound
6-(3-bromo-4,5-dimethoxyphenyl)-5-nitropiperidin-2-one
Catalog ID
STK402968
SMILES COc1c(Br)cc(cc1OC)C1NC(=O)CCC1[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 C13H15BrN2O5 MW 359.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15BrN2O5/c1-20-10-6-7(5-8(14)13(10)21-2)12-9(16(18)19)3-4-11(17)15-12/h5-6,9,12H,3-4H2,1-2H3,(H,15,17)InChIKey
UXKRIFRARWHSDM-UHFFFAOYSA-NSynonyms
442568-64-1(5R6S)6(3BROMO45DIMETHOXYPHENYL)5NITROPIPERIDIN2ONE
(5S6S)6(3BROMO45DIMETHOXYPHENYL)5NITROPIPERIDIN2ONE
442568641
6(3bromo45dimethoxyphenyl)5nitropiperidin2one
COC1=C(C(=CC(=C1)C2C(CCC(=O)N2)(N+)(=O)(O))Br)OC
COc1c(Br)cc(cc1OC)C1NC(=O)CCC1(N+)(=O)(O)
InChI=1SC13H15BrN2O5c1201067(58(14)13(10)212)129(16(18)19)3411(17)1512h56912H34H212H3(H1517)
MFCD03370994
ZINC000002459177
ZINC000002459180
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