Acetic Acid → HCID 21877053, compound
Reaction equation
[CH2:5]1[CH2:6][CH2:7][NH:8][CH2:9][CH2:10]1.[CH3:11][C:12]([CH2:13][C:14]([CH3:15])=[O:16])=[O:17].[CH3:1][C:2](=[O:3])[OH:4].[CH3:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[Cl:18][c:19]1[cH:20][c:21]([CH:22]=[O:23])[cH:24][c:25]([Cl:27])[cH:26]1>>[CH3:11][C:12]([C:13]([C:14]([CH3:15])=[O:16])=[CH:22][c:21]1[cH:20][c:19]([Cl:18])[cH:26][c:25]([Cl:27])[cH:24]1)=[O:17]Participants
6
Sources & evidence
- ORD record
- ord-bc3dfcf67c464df985d26f7575b368f3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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