Vitas-M small molecule compound
1-[3-(naphthalen-1-yl)prop-2-yn-1-yl]-1-(3-phenylprop-2-yn-1-yl)piperidinium
Catalog ID
STL321478
SMILES c1ccc(cc1)C#CC[N+]1(CCCCC1)CC#Cc1cccc2c1cccc2
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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 C27H26N MW 364.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N/c1-3-12-24(13-4-1)14-10-22-28(20-7-2-8-21-28)23-11-18-26-17-9-16-25-15-5-6-19-27(25)26/h1,3-6,9,12-13,15-17,19H,2,7-8,20-23H2/q+1InChIKey
XFQGGWXALLPEGP-UHFFFAOYSA-NSynonyms
1(3(naphthalen1yl)prop2yn1yl)1(3phenylprop2yn1yl)piperidinium
1(3NAPHTHALEN1YLPROP2YNYL)1(3PHENYLPROP2YNYL)PIPERIDIN1IUM
C1CC(N+)(CC1)(CC#CC2=CC=CC=C2)CC#CC3=CC=CC4=CC=CC=C43
c1ccc(cc1)C#CC(N+)1(CCCCC1)CC#Cc1cccc2c1cccc2
InChI=1SC27H26Nc131224(1341)14102228(207282128)23111826179162515561927(25)26h13691213151719H2782023H2q+1
MFCD00608005
ZINC000001749109
ZINC01749109
ZINC1749109
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