Acetic Acid → HCID 59394974, compound
Reaction equation
[C:1]([O:2][c:3]1[c:4]([CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:5][c:6]([Br:12])[c:7]([N+:9]([O-:10])=[O:11])[cH:8]1)([O:18][CH3:19])=[O:20].[CH3:21][C:22](=[O:23])[OH:24].[CH3:26][C:27]#[N:28].[CH3:29][OH:30].[OH2:25]>>[C:1]([O:2][c:3]1[c:4]([CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:5][c:6]([Br:12])[c:7]([NH2:9])[cH:8]1)([O:18][CH3:19])=[O:20]Participants
6
Sources & evidence
- ORD record
- ord-a24616e4b02d4ab7aa0b53dede681ec7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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