Acetone → 4-{4-[4-(3,3-Dimethyl-butyl)-piperazin-1-yl]-butoxy}-3-fluoro-benzoic Acid Ethyl Ester
Reaction equation
[C:1]([O:2][C:6](=[O:3])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:12][CH2:13]1)([CH3:4])([CH3:5])[CH3:7].[C:20](=[O:21])([O-:22])[O-:23].[CH2:28]([CH3:29])[O:30][C:31]([c:32]1[cH:33][c:34]([F:44])[c:35]([O:38][CH2:39][CH2:40][CH2:41][CH2:42][Br:43])[cH:36][cH:37]1)=[O:45].[CH3:46][C:47](=[O:48])[CH3:49].[I-:27].[K+:24].[K+:25].[K+:26]>>[CH2:6]([N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:12][CH2:13]1)[CH2:41][CH2:40][CH2:39][O:38][c:35]1[c:34]([F:44])[cH:33][c:32]([C:31]([O:30][CH2:28][CH3:29])=[O:45])[cH:37][cH:36]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-d4219c28e8304c98a207b3d61fe066c9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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