Vitas-M small molecule compound
1-methyl-3-[(2-phenylbutanoyl)oxy]-1-azoniabicyclo[2.2.2]octane
Catalog ID
STL333165
SMILES CCC(c1ccccc1)C(=O)OC1C[N+]2(C)CCC1CC2
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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 C18H26NO2 MW 288.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26NO2/c1-3-16(14-7-5-4-6-8-14)18(20)21-17-13-19(2)11-9-15(17)10-12-19/h4-8,15-17H,3,9-13H2,1-2H3/q+1InChIKey
UTBRXKLTFZQNMV-UHFFFAOYSA-NSynonyms
(1METHYL1AZONIABICYCLO(222)OCTAN3YL)2PHENYLBUTANOATE
(1s4s)1methyl3((2phenylbutanoyl)oxy)quinuclidin1iumiodide
1methyl3((2phenylbutanoyl)oxy)1azoniabicyclo(222)octane
CCC(C1=CC=CC=C1)C(=O)OC2C(N+)3(CCC2CC3)C
CCC(c1ccccc1)C(=O)OC1C(N+)2(C)CCC1CC2
CCC(c1ccccc1)C(=O)OC1C(N+)2(C)CCC1CC2(I)
InChI=1SC18H26NO2c1316(147546814)18(20)21171319(2)11915(17)101219h481517H3913H212H3q+1
MFCD03286664
ZINC000000403701
ZINC000000403704
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