Vitas-M small molecule compound

2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl acetate

Catalog ID
STK360254
SMILES CC(=O)Oc1ccccc1N1C(=O)c2c(C1=O)cccc2[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 C16H10N2O6 MW 326.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O6/c1-9(19)24-13-8-3-2-6-11(13)17-15(20)10-5-4-7-12(18(22)23)14(10)16(17)21/h2-8H,1H3
InChIKey
XENPBKONCCVRIF-UHFFFAOYSA-N
Synonyms

(2(4NITRO13DIOXOISOINDOL2YL)PHENYL)ACETATE
2(4nitro13dioxo13dihydro2Hisoindol2yl)phenylacetate
CC(=O)OC1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=CC=C3)(N+)(=O)(O)
CC(=O)Oc1ccccc1N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
InChI=1SC16H10N2O6c19(19)2413832611(13)1715(20)1054712(18(22)23)14(10)16(17)21h28H1H3
MFCD00391803
ZINC000000241272
ZINC00241272
ZINC241272

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Available files

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