Acetic Acid → HCID 22312927, compound
Reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:33][C:34](=[O:35])[CH3:36].[Cl:6][c:7]1[c:8]([C:21]([C:22](=[O:23])[Cl:24])([CH3:25])[c:26]2[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]2)[cH:9][cH:10][c:11](-[n:13]2[n:14][cH:15][c:16](=[O:20])[nH:17][c:18]2=[O:19])[cH:12]1.[NH4+:5]>>[NH2:5][C:22]([C:21]([c:8]1[c:7]([Cl:6])[cH:12][c:11](-[n:13]2[n:14][cH:15][c:16](=[O:20])[nH:17][c:18]2=[O:19])[cH:10][cH:9]1)([CH3:25])[c:26]1[cH:27][cH:28][c:29]([Cl:32])[cH:30][cH:31]1)=[O:23]Participants
5
Sources & evidence
- ORD record
- ord-b9b6199eeb2e4dffae56889a8e77a749
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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