Vitas-M small molecule compound

N-(2,4-dimethylphenyl)-3,5-dinitrobenzamide

Catalog ID
STK122040
SMILES Cc1ccc(c(c1)C)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C15H13N3O5 MW 315.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O5/c1-9-3-4-14(10(2)5-9)16-15(19)11-6-12(17(20)21)8-13(7-11)18(22)23/h3-8H,1-2H3,(H,16,19)
InChIKey
KLLCTAKEONEBOK-UHFFFAOYSA-N
Synonyms
36293-10-4
36293104
CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O))C
Cc1ccc(c(c1)C)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC15H13N3O5c193414(10(2)59)1615(19)11612(17(20)21)813(711)18(22)23h38H12H3(H1619)
MFCD00393789
N(24DIMETHYLPHENYL)35DINITROBENZAMIDE
ZINC000001738926
ZINC01738926
ZINC1738926

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Available files

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