Vitas-M small molecule compound
3,3-dimethyl-2-oxobutyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK258339
SMILES O=C1C2C3CCC(C2C(=O)N1c1ccccc1C(=O)OCC(=O)C(C)(C)C)C3
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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 C22H25NO5 MW 383.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO5/c1-22(2,3)16(24)11-28-21(27)14-6-4-5-7-15(14)23-19(25)17-12-8-9-13(10-12)18(17)20(23)26/h4-7,12-13,17-18H,8-11H2,1-3H3InChIKey
QGBTWPVIZQOBMU-UHFFFAOYSA-NSynonyms
33dimethyl2oxobutyl2(13dioxooctahydro2H47methanoisoindol2yl)benzoate
CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1N2C(=O)C3C4CCC(C4)C3C2=O
InChI=1SC22H25NO5c122(23)16(24)112821(27)14645715(14)2319(25)17128913(1012)18(17)20(23)26h4712131718H811H213H3
MFCD03835754
ZINC000100395054
ZINC000239174568
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