Vitas-M small molecule compound
1-(2-chlorobenzyl)-1-[4-(9-hydroxy-9H-fluoren-9-yl)but-2-yn-1-yl]-3-phenylpyrrolidinium
Catalog ID
STL059342
SMILES Clc1ccccc1C[N+]1(CC#CCC2(O)c3ccccc3c3c2cccc3)CCC(C1)c1ccccc1
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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 C34H31ClNO MW 505.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31ClNO/c35-33-19-9-4-14-28(33)25-36(23-20-27(24-36)26-12-2-1-3-13-26)22-11-10-21-34(37)31-17-7-5-15-29(31)30-16-6-8-18-32(30)34/h1-9,12-19,27,37H,20-25H2/q+1InChIKey
JQYUFEUVWGYAJH-UHFFFAOYSA-NSynonyms
1(2chlorobenzyl)1(4(9hydroxy9Hfluoren9yl)but2yn1yl)3phenylpyrrolidin1iumchloride
1(2chlorobenzyl)1(4(9hydroxy9Hfluoren9yl)but2yn1yl)3phenylpyrrolidinium
9(4(1((2CHLOROPHENYL)METHYL)3PHENYLPYRROLIDIN1IUM1YL)BUT2YNYL)FLUOREN9OL
C1C(N+)(CC1C2=CC=CC=C2)(CC#CCC3(C4=CC=CC=C4C5=CC=CC=C53)O)CC6=CC=CC=C6Cl
Clc1ccccc1C(N+)1(CC#CCC2(O)c3ccccc3c3c2cccc3)CCC(C1)c1ccccc1
Clc1ccccc1C(N+)1(CC#CCC2(O)c3ccccc3c3c2cccc3)CCC(C1)c1ccccc1(Cl)
InChI=1SC34H31ClNOc353319941428(33)2536(232027(2436)26122131326)2211102134(37)3117751529(31)3016681832(30)34h1912192737H2025H2q+1
ZINC000245246170
ZINC000245246180
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