Vitas-M small molecule compound

1-methyl-8-(3,4,5-trimethoxyphenyl)-2,6-diazabicyclo[2.2.2]octane-3,5-dione

Catalog ID
STL536576
SMILES COc1cc(cc(c1OC)OC)C1CC2(C)NC(=O)C1C(=O)N2

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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 C16H20N2O5 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O5/c1-16-7-9(12(14(19)17-16)15(20)18-16)8-5-10(21-2)13(23-4)11(6-8)22-3/h5-6,9,12H,7H2,1-4H3,(H,17,19)(H,18,20)
InChIKey
RMOFNLPICOFCTQ-UHFFFAOYSA-N
Synonyms
219498-99-4
15365584
1methyl8(345trimethoxyphenyl)26diazabicyclo(222)octane35dione
219498994
InChI=1SC16H20N2O5c11679(12(14(19)1716)15(20)1816)8510(212)13(234)11(68)223h56912H7H214H3(H1719)(H1820)
MFCD18791164
ZINC000001864264
ZINC000005964016

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Available files

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