Vitas-M small molecule compound
1-(2-chlorobenzyl)-1-[4-(9-hydroxy-9H-fluoren-9-yl)but-2-yn-1-yl]piperidinium
Catalog ID
STK729166
SMILES Clc1ccccc1C[N+]1(CCCCC1)CC#CCC1(O)c2ccccc2c2c1cccc2
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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 C29H29ClNO MW 443.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClNO/c30-28-17-7-2-12-23(28)22-31(19-9-1-10-20-31)21-11-8-18-29(32)26-15-5-3-13-24(26)25-14-4-6-16-27(25)29/h2-7,12-17,32H,1,9-10,18-22H2/q+1InChIKey
ZKUVPSMPRCAVFB-UHFFFAOYSA-NSynonyms
1(2chlorobenzyl)1(4(9hydroxy9Hfluoren9yl)but2yn1yl)piperidin1iumchloride
1(2chlorobenzyl)1(4(9hydroxy9Hfluoren9yl)but2yn1yl)piperidinium
9(4(1((2CHLOROPHENYL)METHYL)PIPERIDIN1IUM1YL)BUT2YNYL)FLUOREN9OL
C1CC(N+)(CC1)(CC#CCC2(C3=CC=CC=C3C4=CC=CC=C42)O)CC5=CC=CC=C5Cl
Clc1ccccc1C(N+)1(CCCCC1)CC#CCC1(O)c2ccccc2c2c1cccc2
Clc1ccccc1C(N+)1(CCCCC1)CC#CCC1(O)c2ccccc2c2c1cccc2(Cl)
InChI=1SC29H29ClNOc302817721223(28)2231(1991102031)211181829(32)2615531324(26)2514461627(25)29h27121732H19101822H2q+1
MFCD02238451
ZINC000002296415
ZINC02296415
ZINC2296415
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