Ethanol → HCID 178428321, compound
Reaction equation
[CH2:34]([OH:35])[CH2:36][CH3:37].[CH3:1][CH:2]1[CH2:3][CH2:4][N:5]([c:8]2[n:9][cH:10][c:11]([N+:21]([O-:22])=[O:23])[c:12]([NH:14][c:15]3[nH:16][n:17][c:18]([CH3:20])[cH:19]3)[n:13]2)[CH2:6][CH2:7]1.[CH3:38][CH2:39][OH:40].[Cl:31][CH2:32][Cl:33].[Na+:30].[OH-:29].[OH2:24].[OH2:25].[Sn:26]([Cl:27])[Cl:28]>>[CH3:1][CH:2]1[CH2:3][CH2:4][N:5]([c:8]2[n:9][cH:10][c:11]([NH2:21])[c:12]([NH:14][c:15]3[nH:16][n:17][c:18]([CH3:20])[cH:19]3)[n:13]2)[CH2:6][CH2:7]1Participants
9
Sources & evidence
- ORD record
- ord-8b5852e550c54131b0099f246208cf0b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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