Acetate → 1-Amino-5-(5-chloro-2-methoxyphenyl)cyclohexen-3-one
Reaction equation
[CH3:19][C:20](=[O:21])[O-:22].[CH3:23][CH2:24][OH:25].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:16][CH3:17])[c:6]([CH:8]2[CH2:9][C:10](=[O:15])[CH2:11][C:12](=[O:14])[CH2:13]2)[cH:7]1.[NH4+:18]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:16][CH3:17])[c:6]([CH:8]2[CH2:9][C:10](=[O:15])[CH:11]=[C:12]([NH2:18])[CH2:13]2)[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-602a75fc414a4e1fa59f626399367a68
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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