Vitas-M small molecule compound
4-bromophenyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate
Catalog ID
STK274925
SMILES O=C(c1ccc(cc1)N1C(=O)C2C(C1=O)CC=CC2)Oc1ccc(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 C21H16BrNO4 MW 426.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO4/c22-14-7-11-16(12-8-14)27-21(26)13-5-9-15(10-6-13)23-19(24)17-3-1-2-4-18(17)20(23)25/h1-2,5-12,17-18H,3-4H2InChIKey
VSNOXLAVMLRBDY-UHFFFAOYSA-NSynonyms
(4BROMOPHENYL)4(13DIOXO3A477ATETRAHYDROISOINDOL2YL)BENZOATE
4bromophenyl4(13dioxo133a477ahexahydro2Hisoindol2yl)benzoate
C1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC4=CC=C(C=C4)Br
InChI=1SC21H16BrNO4c221471116(12814)2721(26)135915(10613)2319(24)17312418(17)20(23)25h125121718H34H2
MFCD03165950
ZINC000017987441
ZINC000095483123
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