Ethanol → HCID 178422351, compound
Reaction equation
[C:25](=[O:26])([O-:27])[OH:28].[CH3:30][CH2:31][OH:32].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([nH:6][c:7](-[c:9]3[n:10][nH:11][cH:12][c:13]3[N+:14]([O-:15])=[O:16])[n:8]2)[cH:17][c:18]1[CH3:19].[Na+:29].[Sn:20]([Cl:21])([Cl:22])([Cl:23])[Cl:24]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([nH:6][c:7](-[c:9]3[n:10][nH:11][cH:12][c:13]3[NH2:14])[n:8]2)[cH:17][c:18]1[CH3:19]Participants
6
Sources & evidence
- ORD record
- ord-3aa73bfe04624b2fb819227c4d68f4d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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