Vitas-M small molecule compound

N-(4-ethoxybenzyl)-3-nitrobenzamide

Catalog ID
STL193978
SMILES CCOc1ccc(cc1)CNC(=O)c1cccc(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 C16H16N2O4 MW 300.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4/c1-2-22-15-8-6-12(7-9-15)11-17-16(19)13-4-3-5-14(10-13)18(20)21/h3-10H,2,11H2,1H3,(H,17,19)
InChIKey
OEHNJFCPDNOMFE-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
CCOc1ccc(cc1)CNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H16N2O4c1222158612(7915)111716(19)1343514(1013)18(20)21h310H211H21H3(H1719)
MFCD09228074
N((4ethoxyphenyl)methyl)3nitrobenzamide
N(4ethoxybenzyl)3nitrobenzamide
ZINC000010448418
ZINC10448418

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Available files

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