Vitas-M small molecule compound

3-[5-(3-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate

Catalog ID
STK295692
SMILES CC(=O)Oc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)[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 C22H14N2O7 MW 418.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O7/c1-13(25)30-16-6-2-4-14(10-16)23-21(26)19-9-8-18(12-20(19)22(23)27)31-17-7-3-5-15(11-17)24(28)29/h2-12H,1H3
InChIKey
OWTQRGYKAQFSLK-UHFFFAOYSA-N
Synonyms

(3(5(3NITROPHENOXY)13DIOXOISOINDOL2YL)PHENYL)ACETATE
3(5(3nitrophenoxy)13dioxo13dihydro2Hisoindol2yl)phenylacetate
3(5(3NITROPHENOXY)13DIOXOBENZO(C)AZOLIN2YL)PHENYLACETATE
CC(=O)OC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)(N+)(=O)(O)
CC(=O)Oc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O)
InChI=1SC22H14N2O7c113(25)301662414(1016)2321(26)199818(1220(19)22(23)27)311773515(1117)24(28)29h212H1H3
MFCD00331264
ZINC000000793762
ZINC00793762
ZINC793762

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Available files

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