Ethanol → 2-Chloro-5-[4-(2-dimethylaminoethyl)-piperazin-1-yl]-benzoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([Cl:22])[cH:7][cH:8][c:9]([N:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[CH2:15][CH2:16]2)[cH:10]1)=[O:23].[CH3:24][CH2:25][OH:26].[Na+:28].[OH-:27]>>[O:3]=[C:4]([c:5]1[c:6]([Cl:22])[cH:7][cH:8][c:9]([N:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[CH2:15][CH2:16]2)[cH:10]1)[OH:23]Participants
5
Sources & evidence
- ORD record
- ord-d889cfb6da8b48e6a330ce3bd13b11be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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