Vitas-M small molecule compound
2-(4-methylphenyl)-2-oxoethyl 3-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)propanoate
Catalog ID
STK268648
SMILES O=C(OCC(=O)c1ccc(cc1)C)CCN1C(=O)C2C(C1=O)C1CC2C(C1Br)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 C21H21Br2NO5 MW 527.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21Br2NO5/c1-10-2-4-11(5-3-10)14(25)9-29-15(26)6-7-24-20(27)16-12-8-13(17(16)21(24)28)19(23)18(12)22/h2-5,12-13,16-19H,6-9H2,1H3InChIKey
ROIGSQZNJHPUNL-UHFFFAOYSA-NSynonyms
2(4methylphenyl)2oxoethyl3(56dibromo13dioxooctahydro2H47methanoisoindol2yl)propanoate
CC1=CC=C(C=C1)C(=O)COC(=O)CCN2C(=O)C3C4CC(C3C2=O)C(C4Br)Br
InChI=1SC21H21Br2NO5c1102411(5310)14(25)92915(26)672420(27)1612813(17(16)21(24)28)19(23)18(12)22h2512131619H69H21H3
MFCD01174831
ZINC000239403164
ZINC000239403167
ZINC08449642
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