Vitas-M small molecule compound
1-phenyl-4-[2-(pyridin-3-yl)piperidinium-1-yl]but-2-yn-1-olate
Catalog ID
STL562871
SMILES [O-]C(c1ccccc1)C#CC[NH+]1CCCCC1c1cccnc1
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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 C20H22N2O MW 306.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N2O/c23-20(17-8-2-1-3-9-17)12-7-15-22-14-5-4-11-19(22)18-10-6-13-21-16-18/h1-3,6,8-10,13,16,19-20H,4-5,11,14-15H2/q-1/p+1InChIKey
LQBPKKDZKTUREX-UHFFFAOYSA-OSynonyms
1phenyl4(2(pyridin3yl)piperidinium1yl)but2yn1olate
1phenyl4(2pyridin3ylpiperidin1ium1yl)but2yn1olate
44666624
InChI=1SC20H21N2Oc2320(178213917)127152214541119(22)1810613211618h13681013161920H45111415H2q1p+1
MFCD06652435
ZINC000055243820
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