Potassium Cation → 5-Chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]benzaldehyde

HRID 156181

Reaction equation

HRID 156181 reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH:6]([CH3:20])[CH2:7][N:8]([CH2:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[CH:9]([CH3:11])[CH2:10]1.[Cl:21][c:22]1[cH:23][cH:24][c:25]([OH:30])[c:26]([CH:27]=[O:28])[cH:29]1.[I-:38].[K+:35].[K+:36].[K+:37]>>[CH2:2]([C:3](=[O:4])[N:5]1[CH:6]([CH3:20])[CH2:7][N:8]([CH2:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[CH:9]([CH3:11])[CH2:10]1)[O:30][c:25]1[cH:24][cH:23][c:22]([Cl:21])[cH:29][c:26]1[CH:27]=[O:28]

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 6228DimethylformamideHCID 124815-Chloro-salicylaldehydeHCID 19660Carbonate IonHCID 30165Iodide IonHCID 219732762-Chloro-1-[4-(4-fluoro-benzyl)-2,5-dimethyl-piperazin-1-yl]-ethanone

Product 1

HCID 219733285-Chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]benzaldehyde

Sources & evidence

ORD record
ord-1c3b187daa9a42f495391ad53a91e45c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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