Vitas-M small molecule compound

N-(2-methylbutan-2-yl)-4-nitrobenzamide

Catalog ID
STK129226
SMILES CCC(NC(=O)c1ccc(cc1)[N+](=O)[O-])(C)C

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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 C12H16N2O3 MW 236.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O3/c1-4-12(2,3)13-11(15)9-5-7-10(8-6-9)14(16)17/h5-8H,4H2,1-3H3,(H,13,15)
InChIKey
YYZVCCUTFIGANK-UHFFFAOYSA-N
Synonyms
183619-60-5
183619605
CCC(C)(C)NC(=O)C1=CC=C(C=C1)(N+)(=O)(O)
CCC(NC(=O)c1ccc(cc1)(N+)(=O)(O))(C)C
InChI=1SC12H16N2O3c1412(23)1311(15)95710(869)14(16)17h58H4H213H3(H1315)
MFCD04218997
N(11DIMETHYLPROPYL)(4NITROPHENYL)CARBOXAMIDE
N(2METHYLBUTAN2YL)4NITROBENZAMIDE
ZINC000000620451
ZINC00620451
ZINC620451

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Available files

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