Vitas-M small molecule compound
4-bromophenyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)propanoate
Catalog ID
STK286541
SMILES O=C(Oc1ccc(cc1)Br)CCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C20H18BrNO4 MW 416.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrNO4/c21-10-1-3-11(4-2-10)26-16(23)7-8-22-19(24)17-12-5-6-13(15-9-14(12)15)18(17)20(22)25/h1-6,12-15,17-18H,7-9H2InChIKey
YXLOWKBVOAIKOB-UHFFFAOYSA-NSynonyms
4bromophenyl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)propanoate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CCC(=O)OC5=CC=C(C=C5)Br
InChI=1SC20H18BrNO4c21101311(4210)2616(23)782219(24)17125613(15914(12)15)18(17)20(22)25h1612151718H79H2
MFCD03578059
ZINC000104294546
ZINC000239434041
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