Vitas-M small molecule compound

N-(2,6-diethylphenyl)-3,5-dinitrobenzamide

Catalog ID
STK417752
SMILES CCc1cccc(c1NC(=O)c1cc(cc(c1)[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 C17H17N3O5 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5/c1-3-11-6-5-7-12(4-2)16(11)18-17(21)13-8-14(19(22)23)10-15(9-13)20(24)25/h5-10H,3-4H2,1-2H3,(H,18,21)
InChIKey
KLVKOTOSOWBSMY-UHFFFAOYSA-N
Synonyms
33581-01-0
33581010
BENZAMIDEN(26DIETHYLPHENYL)35DINITRO
CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCc1cccc(c1NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))CC
InChI=1SC17H17N3O5c131165712(42)16(11)1817(21)13814(19(22)23)1015(913)20(24)25h510H34H212H3(H1821)
MFCD00031261
N(26DIETHYLPHENYL)(35DINITROPHENYL)CARBOXAMIDE
N(26diethylphenyl)35dinitrobenzamide
ZINC000002156326
ZINC02156326
ZINC2156326

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Available files

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