Vitas-M small molecule compound

N-(4-methoxybenzyl)-2-methyl-3-nitrobenzamide

Catalog ID
STK094033
SMILES COc1ccc(cc1)CNC(=O)c1cccc(c1C)[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/c1-11-14(4-3-5-15(11)18(20)21)16(19)17-10-12-6-8-13(22-2)9-7-12/h3-9H,10H2,1-2H3,(H,17,19)
InChIKey
KXPUEESUHBIRII-UHFFFAOYSA-N
Synonyms
314053-96-8
314053968
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NCC2=CC=C(C=C2)OC
COc1ccc(cc1)CNC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC16H16N2O4c11114(43515(11)18(20)21)16(19)1710126813(222)9712h39H10H212H3(H1719)
MFCD00814668
N((4METHOXYPHENYL)METHYL)(2METHYL3NITROPHENYL)CARBOXAMIDE
N((4METHOXYPHENYL)METHYL)2METHYL3NITROBENZAMIDE
N(4METHOXYBENZYL)2METHYL3NITROBENZAMIDE
STK094033
ZINC000000252998
ZINC00252998
ZINC252998

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Available files

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