Vitas-M small molecule compound
3,3-dimethyl-2-oxobutyl 3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK389098
SMILES O=C1N(c2cccc(c2)C(=O)OCC(=O)C(C)(C)C)C(=O)C2C1C1CCC2C1
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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)14-5-4-6-15(10-14)23-19(25)17-12-7-8-13(9-12)18(17)20(23)26/h4-6,10,12-13,17-18H,7-9,11H2,1-3H3InChIKey
YVPPPSSLWAFOTN-UHFFFAOYSA-NSynonyms
33dimethyl2oxobutyl3(13dioxooctahydro2H47methanoisoindol2yl)benzoate
CC(C)(C)C(=O)COC(=O)C1=CC(=CC=C1)N2C(=O)C3C4CCC(C4)C3C2=O
InChI=1SC22H25NO5c122(23)16(24)112821(27)1454615(1014)2319(25)17127813(912)18(17)20(23)26h461012131718H7911H213H3
MFCD03835753
ZINC000100395046
ZINC000239433973
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