Ethanol → HCID 22172586, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:20]([CH:21]([CH2:22][CH3:23])[CH2:24][CH3:25])[n:26]2[c:27](-[c:44]3[cH:45][cH:46][c:47]([CH3:50])[cH:48][cH:49]3)[n:28][c:29]([CH2:31][CH2:32][N:33]3[C:34](=[O:35])[c:36]4[c:37]([cH:38][cH:39][cH:40][cH:41]4)[C:42]3=[O:43])[cH:30]2)[n:10][c:11]2[n:12][c:13]([Cl:19])[n:14][cH:15][c:16]2[c:17]1=[O:18].[CH3:53][CH2:54][OH:55].[NH2:51][NH2:52]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:20]([CH:21]([CH2:22][CH3:23])[CH2:24][CH3:25])[n:26]2[c:27](-[c:44]3[cH:45][cH:46][c:47]([CH3:50])[cH:48][cH:49]3)[n:28][c:29]([CH2:31][CH2:32][NH2:33])[cH:30]2)[n:10][c:11]2[n:12][c:13]([Cl:19])[n:14][cH:15][c:16]2[c:17]1=[O:18]Participants
4
Sources & evidence
- ORD record
- ord-a6c15588ab084000b24bb0268f098ace
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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