Vitas-M small molecule compound

N-(4-methoxyphenyl)-3-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide

Catalog ID
STK757763
SMILES COc1ccc(cc1)NC(=O)c1cccc(c1)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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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 C21H15F3N2O5 MW 432.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F3N2O5/c1-30-16-8-6-15(7-9-16)25-20(27)13-3-2-4-17(11-13)31-19-10-5-14(21(22,23)24)12-18(19)26(28)29/h2-12H,1H3,(H,25,27)
InChIKey
KJBHOXFJXAOFHC-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
COc1ccc(cc1)NC(=O)c1cccc(c1)Oc1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC21H15F3N2O5c130168615(7916)2520(27)1332417(1113)311910514(21(2223)24)1218(19)26(28)29h212H1H3(H2527)
MFCD01235186
N(4methoxyphenyl)3(2nitro4(trifluoromethyl)phenoxy)benzamide
ZINC000001059956
ZINC01059956
ZINC1059956

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Available files

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