Ethanol → HCID 58914783, compound
Reaction equation
[CH3:40][C:41]#[N:42].[CH3:43][CH2:44][OH:45].[Cl:1][c:2]1[c:3](-[c:9]2[c:10]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:11][n:12]([CH2:14][CH2:15][CH2:16][N:17]3[C:18](=[O:19])[c:20]4[cH:21][cH:22][cH:23][cH:24][c:25]4[C:26]3=[O:27])[cH:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:37][CH2:38][Cl:39].[NH2:35][NH2:36]>>[Cl:1][c:2]1[c:3](-[c:9]2[c:10]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:11][n:12]([CH2:14][CH2:15][CH2:16][NH2:17])[cH:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-6f7e63d226cc4278893a1117ccc36452
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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