Vitas-M small molecule compound

N-(2-methoxy-5-methylphenyl)-2-methyl-3-nitrobenzamide

Catalog ID
STK161393
SMILES COc1ccc(cc1NC(=O)c1cccc(c1C)[N+](=O)[O-])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 C16H16N2O4 MW 300.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4/c1-10-7-8-15(22-3)13(9-10)17-16(19)12-5-4-6-14(11(12)2)18(20)21/h4-9H,1-3H3,(H,17,19)
InChIKey
HPQYHQIJQFSROF-UHFFFAOYSA-N
Synonyms
349122-13-0
349122130
CC1=CC(=C(C=C1)OC)NC(=O)C2=C(C(=CC=C2)(N+)(=O)(O))C
COc1ccc(cc1NC(=O)c1cccc(c1C)(N+)(=O)(O))C
InChI=1SC16H16N2O4c1107815(223)13(910)1716(19)1254614(11(12)2)18(20)21h49H13H3(H1719)
MFCD01356576
N(2METHOXY5METHYLPHENYL)2METHYL3NITROBENZAMIDE
ZINC000000447748
ZINC00447748
ZINC447748

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Available files

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