Ethanol → HCID 68923307, compound
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][N:7]([CH3:8])[c:9]1[cH:10][cH:11][c:12]([C:15](=[O:16])[N:17]2[CH:18]([CH3:38])[CH2:19][CH:20]([N:27]([c:28]3[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]3)[C:35]([CH3:36])=[O:37])[c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]32)[cH:13][cH:14]1)=[O:39].[CH3:40][CH2:41][OH:42].[Li+:43].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH-:44]>>[O:2]=[C:3]([CH2:4][CH2:5][CH2:6][N:7]([CH3:8])[c:9]1[cH:10][cH:11][c:12]([C:15](=[O:16])[N:17]2[CH:18]([CH3:38])[CH2:19][CH:20]([N:27]([c:28]3[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]3)[C:35]([CH3:36])=[O:37])[c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]32)[cH:13][cH:14]1)[OH:39]Participants
6
Sources & evidence
- ORD record
- ord-b99521af5fbe45aabd1f631bb19a1511
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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