Acetic Acid → HCID 9840885, compound
Reaction equation
[CH2:27]([Cl:28])[Cl:29].[CH3:30][C:31](=[O:32])[OH:33].[O:1]1[CH2:2][CH2:3][c:4]2[c:5]1[c:6]([CH:10]1[CH2:11][N:12]([CH3:22])[CH2:13][CH2:14][c:15]3[c:16]1[cH:17][c:18]([OH:21])[cH:19][cH:20]3)[cH:7][cH:8][cH:9]2.[OH:23][N+:24]([O-:25])=[O:26]>>[O:1]1[CH2:2][CH2:3][c:4]2[c:5]1[c:6]([CH:10]1[CH2:11][N:12]([CH3:22])[CH2:13][CH2:14][c:15]3[c:16]1[cH:17][c:18]([OH:21])[c:19]([N+:24](=[O:23])[O-:25])[cH:20]3)[cH:7][cH:8][cH:9]2Participants
5
Sources & evidence
- ORD record
- ord-1580711e059a4dc7ab76fa9eb809182e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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