Vitas-M small molecule compound
1-benzyl-4,4-diphenyl-1-(3-phenylprop-2-yn-1-yl)piperidinium
Catalog ID
STL327252
SMILES c1ccc(cc1)C#CC[N+]1(CCC(CC1)(c1ccccc1)c1ccccc1)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 C33H32N MW 442.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N/c1-5-14-29(15-6-1)18-13-25-34(28-30-16-7-2-8-17-30)26-23-33(24-27-34,31-19-9-3-10-20-31)32-21-11-4-12-22-32/h1-12,14-17,19-22H,23-28H2/q+1InChIKey
JOWZGRNPBOZMLN-UHFFFAOYSA-NSynonyms
1benzyl44diphenyl1(3phenylprop2yn1yl)piperidin1iumchloride
1benzyl44diphenyl1(3phenylprop2yn1yl)piperidinium
1BENZYL44DIPHENYL1(3PHENYLPROP2YNYL)PIPERIDIN1IUM
C1C(N+)(CCC1(C2=CC=CC=C2)C3=CC=CC=C3)(CC#CC4=CC=CC=C4)CC5=CC=CC=C5
c1ccc(cc1)C#CC(N+)1(CCC(CC1)(c1ccccc1)c1ccccc1)Cc1ccccc1
c1ccc(cc1)C#CC(N+)1(CCC(CC1)(c1ccccc1)c1ccccc1)Cc1ccccc1(Cl)
InChI=1SC33H32Nc151429(1561)18132534(2830167281730)262333(242734311993102031)3221114122232h11214171922H2328H2q+1
MFCD01942291
ZINC000009183455
ZINC09183455
ZINC9183455
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