Hydroxide → 2-[[5-Chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]phenyl]methyl-methylamino]acetic acid
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][N:5]([CH3:6])[CH2:7][c:8]1[c:9]([O:15][CH2:16][C:17](=[O:18])[N:19]2[CH:20]([CH3:34])[CH2:21][N:22]([CH2:26][c:27]3[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]3)[CH:23]([CH3:25])[CH2:24]2)[cH:10][cH:11][c:12]([Cl:14])[cH:13]1)=[O:35].[Li+:43].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH-:42].[OH2:41].[OH2:44]>>[O:2]=[C:3]([CH2:4][N:5]([CH3:6])[CH2:7][c:8]1[c:9]([O:15][CH2:16][C:17](=[O:18])[N:19]2[CH:20]([CH3:34])[CH2:21][N:22]([CH2:26][c:27]3[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]3)[CH:23]([CH3:25])[CH2:24]2)[cH:10][cH:11][c:12]([Cl:14])[cH:13]1)[OH:35]Participants
6
Sources & evidence
- ORD record
- ord-611dc6146f2149c4a7b608aa5d098537
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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