Vitas-M small molecule compound
2-(3-acetylphenyl)-4,7-dimethyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STL387187
SMILES O=C1N(c2cccc(c2)C(=O)C)C(=O)C2C1C1(C)C=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 C18H17NO4 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO4/c1-10(20)11-5-4-6-12(9-11)19-15(21)13-14(16(19)22)18(3)8-7-17(13,2)23-18/h4-9,13-14H,1-3H3InChIKey
NQIVTCUMWSFSLH-UHFFFAOYSA-NSynonyms
2(3acetylphenyl)47dimethyl3a477atetrahydro1H47epoxyisoindole13(2H)dione
2(3acetylphenyl)47dimethyl3a7adihydrooctahydro1H47epoxyisoindole13dione
CC(=O)C1=CC(=CC=C1)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)C
InChI=1SC18H17NO4c110(20)1154612(911)1915(21)1314(16(19)22)18(3)8717(132)2318h491314H13H3
MFCD01142135
ZINC000169682287
ZINC000169682289
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