Ethanol → HCID 11230072, compound
Reaction equation
[CH3:19][CH2:20][OH:21].[Cl:1][c:2]1[c:3]([CH:11]([OH:12])[c:13]2[n:14][cH:15][cH:16][cH:17][cH:18]2)[cH:4][cH:5][c:6]([N+:8]([O-:9])=[O:10])[cH:7]1.[Na+:24].[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[OH2:22].[SH-:23]>>[Cl:1][c:2]1[c:3]([CH:11]([OH:12])[c:13]2[n:14][cH:15][cH:16][cH:17][cH:18]2)[cH:4][cH:5][c:6]([NH2:8])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-69544cc7f2c4410b84e0732cc6e35391
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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