Acetic Acid → HCID 25001822, compound
Reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][CH2:40][OH:41].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][o:14][c:15](-[c:17]3[cH:18][cH:19][c:20]([C:23]([CH3:24])([CH3:25])[NH:26][CH2:27][CH2:28][C:29](=[O:30])[O:31][CH3:32])[cH:21][cH:22]3)[n:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11].[Cl:42][CH2:43][Cl:44].[ClH:45].[Na+:34].[OH-:33]>>[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][o:14][c:15](-[c:17]3[cH:18][cH:19][c:20]([C:23]([CH3:24])([CH3:25])[NH:26][CH2:27][CH2:28][C:29](=[O:30])[OH:31])[cH:21][cH:22]3)[n:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11]Participants
8
Sources & evidence
- ORD record
- ord-a00e258360d84db482f9d21eba2d69f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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