Vitas-M small molecule compound
1-benzyl-1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)piperidinium
Catalog ID
STL329597
SMILES OC(c1ccccc1)(c1ccccc1)C#CC[N+]1(CCCCC1)Cc1ccccc1
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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 C28H30NO MW 396.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30NO/c30-28(26-16-7-2-8-17-26,27-18-9-3-10-19-27)20-13-23-29(21-11-4-12-22-29)24-25-14-5-1-6-15-25/h1-3,5-10,14-19,30H,4,11-12,21-24H2/q+1InChIKey
SGAORLDIVAMZKB-UHFFFAOYSA-NSynonyms
1benzyl1(4hydroxy44diphenylbut2yn1yl)piperidin1iumchloride
1benzyl1(4hydroxy44diphenylbut2yn1yl)piperidinium
4(1BENZYLPIPERIDIN1IUM1YL)11DIPHENYLBUT2YN1OL
C1CC(N+)(CC1)(CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4=CC=CC=C4
InChI=1SC28H30NOc3028(26167281726271893101927)20132329(21114122229)2425145161525h13510141930H411122124H2q+1
MFCD01946607
ZINC000002333631
ZINC02333631
ZINC2333631
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