Acetic Acid → HCID 21980885, compound
Reaction equation
[CH3:1][C:2]([OH:3])=[O:4].[CH3:5][C:6]([O:7][C:8](=[O:9])[CH3:10])=[O:11].[Cl:40][CH2:41][Cl:42].[NH2:12][c:13]1[cH:14][c:15]2[c:16]3[c:17]4[c:18]([c:19](-[c:27]5[c:28]([O:33][CH3:34])[cH:29][cH:30][cH:31][cH:32]5)[cH:20][c:21]3[n:22]([CH3:26])[c:23]2[cH:24][cH:25]1)[C:35](=[O:39])[NH:36][C:37]4=[O:38]>>[CH3:1][C:2](=[O:4])[NH:12][c:13]1[cH:14][c:15]2[c:16]3[c:17]4[c:18]([c:19](-[c:27]5[c:28]([O:33][CH3:34])[cH:29][cH:30][cH:31][cH:32]5)[cH:20][c:21]3[n:22]([CH3:26])[c:23]2[cH:24][cH:25]1)[C:35](=[O:39])[NH:36][C:37]4=[O:38]Participants
5
Sources & evidence
- ORD record
- ord-66d9c062a8634c80932cc03ba12bc99e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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