Vitas-M small molecule compound
2-(4-bromophenyl)-2-oxoethyl (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetate
Catalog ID
STK359307
SMILES O=C(CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2)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 C21H18BrNO5 MW 444.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO5/c22-11-3-1-10(2-4-11)16(24)9-28-17(25)8-23-20(26)18-12-5-6-13(15-7-14(12)15)19(18)21(23)27/h1-6,12-15,18-19H,7-9H2InChIKey
IRYHDWVLKQAVEH-UHFFFAOYSA-NSynonyms
2(4bromophenyl)2oxoethyl(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)OCC(=O)C5=CC=C(C=C5)Br
InChI=1SC21H18BrNO5c22113110(2411)16(24)92817(25)82320(26)18125613(15714(12)15)19(18)21(23)27h1612151819H79H2
MFCD02314571
ZINC000245226131
ZINC000245226134
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