Vitas-M small molecule compound
2-(3-bromo-4-methylphenyl)-4-methyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STL387148
SMILES O=C1N(c2ccc(c(c2)Br)C)C(=O)C2C1C1C=CC2(O1)C
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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 C16H14BrNO3 MW 348.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO3/c1-8-3-4-9(7-10(8)17)18-14(19)12-11-5-6-16(2,21-11)13(12)15(18)20/h3-7,11-13H,1-2H3InChIKey
HPKRRHAKRSMEKJ-UHFFFAOYSA-NSynonyms
2(3bromo4methylphenyl)4methyl3a477atetrahydro1H47epoxyisoindole13(2H)dione
2(3bromo4methylphenyl)7methyl47adihydro3aHoctahydro1H47epoxyisoindole13dione
CC1=C(C=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)C)Br
InChI=1SC16H14BrNO3c18349(710(8)17)1814(19)12115616(22111)13(12)15(18)20h371113H12H3
MFCD00299641
ZINC000143744072
ZINC000239309423
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