Water → 4-(4-Methyl-3-nitro-benzyl)-piperazine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:20]([CH3:21])([CH3:22])([CH3:23])[O:24][C:25](=[O:26])[N:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[C:34]([O:35][CH2:36][CH3:37])(=[O:38])[CH3:39].[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[Cl:1][CH2:2][c:3]1[cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([CH3:9])[cH:7][cH:8]1.[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[OH2:33]>>[CH2:2]([c:3]1[cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([CH3:9])[cH:7][cH:8]1)[N:30]1[CH2:29][CH2:28][N:27]([C:25]([O:24][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:26])[CH2:32][CH2:31]1Participants
7
Sources & evidence
- ORD record
- ord-2aa232cf454d4cefbb6c47c5515229c1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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