Vitas-M small molecule compound

N-(5-chloro-2-methyl-4-nitrophenyl)-3,4,5-trimethoxybenzamide

Catalog ID
STK036309
SMILES COc1c(OC)cc(cc1OC)C(=O)Nc1cc(Cl)c(cc1C)[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 C17H17ClN2O6 MW 380.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O6/c1-9-5-13(20(22)23)11(18)8-12(9)19-17(21)10-6-14(24-2)16(26-4)15(7-10)25-3/h5-8H,1-4H3,(H,19,21)
InChIKey
VBLODYCOJZUJDL-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)Cl)(N+)(=O)(O)
COc1c(OC)cc(cc1OC)C(=O)Nc1cc(Cl)c(cc1C)(N+)(=O)(O)
InChI=1SC17H17ClN2O6c19513(20(22)23)11(18)812(9)1917(21)10614(242)16(264)15(710)253h58H14H3(H1921)
MFCD03016115
N(5CHLORO2METHYL4NITROPHENYL)345TRIMETHOXYBENZAMIDE
STK036309
ZINC000004615253
ZINC04615253
ZINC4615253

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Available files

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