Ammonium → 2-(2'-Chloro-4'-aminophenyl)-5,5-dimethyl-1,3-cyclohexanedione
Reaction equation
[CH3:24][CH2:25][OH:26].[Cl:1][c:2]1[c:3]([CH:11]2[C:12](=[O:20])[CH2:13][C:14]([CH3:18])([CH3:19])[CH2:15][C:16]2=[O:17])[cH:4][cH:5][c:6]([N+:8]([O-:9])=[O:10])[cH:7]1.[NH4+:22].[OH-:23].[SH2:21]>>[Cl:1][c:2]1[c:3]([CH:11]2[C:12](=[O:20])[CH2:13][C:14]([CH3:18])([CH3:19])[CH2:15][C:16]2=[O:17])[cH:4][cH:5][c:6]([NH2:8])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-c0fdf39baa2d421395e790c79a62488b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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