Vitas-M small molecule compound

2-oxo-2-phenylethyl (5-bromo-6-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate

Catalog ID
STK388628
SMILES O=C(CN1C(=O)c2c(C1=O)cc(c(c2)Br)[N+](=O)[O-])OCC(=O)c1ccccc1

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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 C18H11BrN2O7 MW 447.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11BrN2O7/c19-13-6-11-12(7-14(13)21(26)27)18(25)20(17(11)24)8-16(23)28-9-15(22)10-4-2-1-3-5-10/h1-7H,8-9H2
InChIKey
XKCSFKLIMLIJEW-UHFFFAOYSA-N
Synonyms
312947-84-5
2oxo2phenylethyl(5bromo6nitro13dioxo13dihydro2Hisoindol2yl)acetate
312947845
C1=CC=C(C=C1)C(=O)COC(=O)CN2C(=O)C3=CC(=C(C=C3C2=O)Br)(N+)(=O)(O)
InChI=1SC18H11BrN2O7c191361112(714(13)21(26)27)18(25)20(17(11)24)816(23)28915(22)104213510h17H89H2
MFCD02068103
O=C(CN1C(=O)c2c(C1=O)cc(c(c2)Br)(N+)(=O)(O))OCC(=O)c1ccccc1
PHENACYL2(5BROMO6NITRO13DIOXOISOINDOL2YL)ACETATE
ZINC000001170959
ZINC01170959
ZINC1170959

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Available files

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