Vitas-M small molecule compound
2-(4-bromophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanoate
Catalog ID
STK268433
SMILES CC(N1C(=O)C2C(C1=O)C1CC2C=C1)C(=O)OCC(=O)c1ccc(cc1)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 C20H18BrNO5 MW 432.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrNO5/c1-10(20(26)27-9-15(23)11-4-6-14(21)7-5-11)22-18(24)16-12-2-3-13(8-12)17(16)19(22)25/h2-7,10,12-13,16-17H,8-9H2,1H3InChIKey
DVSSZZYKNXCIRL-UHFFFAOYSA-NSynonyms
2(4bromophenyl)2oxoethyl2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)propanoate
CC(C(=O)OCC(=O)C1=CC=C(C=C1)Br)N2C(=O)C3C4CC(C3C2=O)C=C4
InChI=1SC20H18BrNO5c110(20(26)27915(23)114614(21)7511)2218(24)16122313(812)17(16)19(22)25h271012131617H89H21H3
MFCD01156444
ZINC000100538042
ZINC000239038750
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