Vitas-M small molecule compound

4-butyl-N-(3-nitrophenyl)benzamide

Catalog ID
STK734676
SMILES CCCCc1ccc(cc1)C(=O)Nc1cccc(c1)[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 C17H18N2O3 MW 298.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3/c1-2-3-5-13-8-10-14(11-9-13)17(20)18-15-6-4-7-16(12-15)19(21)22/h4,6-12H,2-3,5H2,1H3,(H,18,20)
InChIKey
VGSKIXNORZMDNL-UHFFFAOYSA-N
Synonyms

(4BUTYLPHENYL)N(3NITROPHENYL)CARBOXAMIDE
4BUTYLN(3NITROPHENYL)BENZAMIDE
BENZAMIDEN(3NITROPHENYL)4BUTYL
CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)(N+)(=O)(O)
CCCCc1ccc(cc1)C(=O)Nc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H18N2O3c12351381014(11913)17(20)181564716(1215)19(21)22h4612H235H21H3(H1820)
MFCD00403686
ZINC000003151092
ZINC03151092
ZINC3151092

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Available files

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