Ethanol → HCID 13910043, compound
Reaction equation
[CH2:25]([CH3:26])[O:27][CH2:28][CH2:29][Br:30].[CH3:31][CH2:32][OH:33].[Cl:1][c:2]1[c:3]([NH:9][CH2:10][CH2:11][O:12][c:13]2[c:14]([CH3:22])[cH:15][c:16]([CH2:19][CH2:20][OH:21])[cH:17][cH:18]2)[n:4][cH:5][n:6][c:7]1[CH3:8].[H-:23].[Na+:24].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH2:39]>>[Cl:1][c:2]1[c:3]([NH:9][CH2:10][CH2:11][O:12][c:13]2[c:14]([CH3:22])[cH:15][c:16]([CH2:19][O:33][CH2:29][CH2:28][O:27][CH2:25][CH3:26])[cH:17][cH:18]2)[n:4][cH:5][n:6][c:7]1[CH3:8]Participants
8
Sources & evidence
- ORD record
- ord-1b6ee80afadf4b53bffa122566d44778
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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