Acetic Acid → HCID 23372743, compound
Reaction equation
[C:31](=[O:32])([OH:33])[O-:34].[CH3:1][S:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10](-[c:14]3[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]3)[s:11][cH:12][cH:13]2)[cH:7][cH:8]1.[CH3:36][C:37](=[O:38])[OH:39].[Cl:23][N:24]1[C:25](=[O:26])[CH2:27][CH2:28][C:29]1=[O:30].[Na+:35]>>[CH3:1][S:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10](-[c:14]3[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]3)[s:11][c:12]([Cl:23])[cH:13]2)[cH:7][cH:8]1Participants
6
Sources & evidence
- ORD record
- ord-9c5b8ae3442a40a59b5ba6d0cccbcf89
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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