Vitas-M small molecule compound
methyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)benzoate
Catalog ID
STK280926
SMILES COC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1CCC2C=C1
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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/c1-23-18(22)12-3-2-4-13(9-12)19-16(20)14-10-5-6-11(8-7-10)15(14)17(19)21/h2-6,9-11,14-15H,7-8H2,1H3InChIKey
HQEHIMYMQAMNDY-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=CC=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4
InChI=1SC18H17NO4c12318(22)1232413(912)1916(20)14105611(8710)15(14)17(19)21h269111415H78H21H3
methyl3(13dioxo133a477ahexahydro2H47ethanoisoindol2yl)benzoate
MFCD01306029
ZINC000100064488
ZINC000101358004
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