Ethanol → HCID 59674122, compound
Reaction equation
[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1.[CH3:1][n:2]1[c:3]([NH2:12])[n:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([NH2:11])[cH:10]2.[CH3:31][CH2:32][OH:33].[Cl:18][c:19]1[n:20][cH:21][cH:22][c:23]([Cl:25])[n:24]1.[Na+:17].[O-:13][C:14]([OH:15])=[O:16]>>[CH3:1][n:2]1[c:3]([NH2:12])[n:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([NH:11][c:23]1[cH:22][cH:21][n:20][c:19]([Cl:18])[n:24]1)[cH:10]2Participants
7
Sources & evidence
- ORD record
- ord-d9a71be02c0145e4b92bdbd5ce511253
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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