Ethanol → HCID 66758142, compound
Reaction equation
[CH3:35][CH2:36][OH:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:34])[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH:16]=[C:17]3[c:18]4[c:19]([cH:28][cH:29][c:30]([C:32]#[N:33])[cH:31]4)[O:20][CH2:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][cH:27]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:34])[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH:16]=[C:17]3[c:18]4[c:19]([cH:28][cH:29][c:30]([CH2:32][NH2:33])[cH:31]4)[O:20][CH2:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][cH:27]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-f04f5030f0284068827e55211177968f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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