Vitas-M small molecule compound

methyl 1-[(2-methyl-5-nitro-1H-imidazol-1-yl)acetyl]piperidine-4-carboxylate

Catalog ID
STK697515
SMILES COC(=O)C1CCN(CC1)C(=O)Cn1c(C)ncc1[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 C13H18N4O5 MW 310.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O5/c1-9-14-7-11(17(20)21)16(9)8-12(18)15-5-3-10(4-6-15)13(19)22-2/h7,10H,3-6,8H2,1-2H3
InChIKey
XYMYMIONGRUVSI-UHFFFAOYSA-N
Synonyms
929838-67-5
929838675
CC1=NC=C(N1CC(=O)N2CCC(CC2)C(=O)OC)(N+)(=O)(O)
COC(=O)C1CCN(CC1)C(=O)Cn1c(C)ncc1(N+)(=O)(O)
InChI=1SC13H18N4O5c1914711(17(20)21)16(9)812(18)155310(4615)13(19)222h710H368H212H3
methyl1((2methyl5nitro1Himidazol1yl)acetyl)piperidine4carboxylate
methyl1(2(2methyl5nitro1Himidazol1yl)acetyl)piperidine4carboxylate
methyl1(2(2methyl5nitroimidazol1yl)acetyl)piperidine4carboxylate
MFCD09217550
ZINC000009420761
ZINC09420761
ZINC9420761

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.