Vitas-M small molecule compound

N,N-diethyl-2-methyl-3,5-dinitrobenzamide

Catalog ID
STK395746
SMILES CCN(C(=O)c1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-])CC

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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 C12H15N3O5 MW 281.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O5/c1-4-13(5-2)12(16)10-6-9(14(17)18)7-11(8(10)3)15(19)20/h6-7H,4-5H2,1-3H3
InChIKey
ZKZOWSJSZQONHL-UHFFFAOYSA-N
Synonyms

CCN(C(=O)c1cc(cc(c1C)(N+)(=O)(O))(N+)(=O)(O))CC
CCN(CC)C(=O)C1=CC(=CC(=C1C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC12H15N3O5c1413(52)12(16)1069(14(17)18)711(8(10)3)15(19)20h67H45H213H3
MFCD00426662
NNDIETHYL(2METHYL35DINITROPHENYL)CARBOXAMIDE
NNdiethyl2methyl35dinitrobenzamide
ZINC000003156557
ZINC03156557
ZINC3156557

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Available files

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