Vitas-M small molecule compound

(5'-bromo-2'-oxospiro[1,3-dioxane-2,3'-indol]-1'(2'H)-yl)acetonitrile

Catalog ID
STK246393
SMILES N#CCN1c2ccc(cc2C2(C1=O)OCCCO2)Br

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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 C13H11BrN2O3 MW 323.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN2O3/c14-9-2-3-11-10(8-9)13(18-6-1-7-19-13)12(17)16(11)5-4-15/h2-3,8H,1,5-7H2
InChIKey
LRFIVBYMUXXOMI-UHFFFAOYSA-N
Synonyms

(5BROMO2OXO12DIHYDROSPIRO((13)DIOXANE23INDOLE)1YL)ACETONITRILE
(5bromo2oxospiro(13dioxane23indol)1(2H)yl)acetonitrile
2(11BROMO8OXOSPIRO(13DIOXANE23INDOLINE)7YL)ETHANENITRILE
2(5bromo2oxospiro(13dioxane23indole)1yl)acetonitrile
C1COC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#N)OC1
InChI=1SC13H11BrN2O3c149231110(89)13(186171913)12(17)16(11)5415h238H157H2
MFCD07441560
ZINC000007997862
ZINC07997862
ZINC7997862

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Available files

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