Ethanol → HCID 85898813, compound
Reaction equation
[CH3:35][CH2:36][OH:37].[Cl:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][NH:16][c:17]1[c:18]([CH3:34])[c:19]([CH3:33])[n:20][c:21]([O:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:22]1[N+:23]([O-:24])=[O:25].[Na+:7].[Na+:8].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH2:43].[S:1]([S:2]([O-:3])=[O:4])([O-:5])=[O:6]>>[Cl:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][NH:16][c:17]1[c:18]([CH3:34])[c:19]([CH3:33])[n:20][c:21]([O:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:22]1[NH2:23]Participants
7
Sources & evidence
- ORD record
- ord-7ae83adead6742b19df9cb41e95e3b38
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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