Vitas-M small molecule compound

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

Catalog ID
STK223437
SMILES CC(=O)Oc1ccc(cc1N1C(=O)c2c(C1=O)cccc2[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 C17H12N2O6 MW 340.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O6/c1-9-6-7-14(25-10(2)20)13(8-9)18-16(21)11-4-3-5-12(19(23)24)15(11)17(18)22/h3-8H,1-2H3
InChIKey
IXGCHWFZAQTUAY-UHFFFAOYSA-N
Synonyms

(4METHYL2(4NITRO13DIOXOISOINDOL2YL)PHENYL)ACETATE
2(4NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)4METHYLPHENYLACETATE
4methyl2(4nitro13dioxo13dihydro2Hisoindol2yl)phenylacetate
4METHYL2(4NITRO13DIOXOBENZO(C)AZOLIDIN2YL)PHENYLACETATE
CC(=O)Oc1ccc(cc1N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O))C
CC1=CC(=C(C=C1)OC(=O)C)N2C(=O)C3=C(C2=O)C(=CC=C3)(N+)(=O)(O)
InChI=1SC17H12N2O6c196714(2510(2)20)13(89)1816(21)1143512(19(23)24)15(11)17(18)22h38H12H3
MFCD02189498
ZINC000000313105
ZINC00313105
ZINC313105

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Available files

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