Ethanol → HCID 13202335, compound
Reaction equation
[CH3:33][CH2:34][OH:35].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:29][cH:30]1)-[c:6]1[c:7]([cH:24][n+:25]([O-:28])[cH:26][n:27]1)[CH2:8][N:9]([C:18](=[O:19])[C:20]([F:21])([F:22])[F:23])[CH:10]2[c:11]1[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]1.[Na+:32].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH-:31]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:29][cH:30]1)-[c:6]1[c:7]([cH:24][n+:25]([O-:28])[cH:26][n:27]1)[CH2:8][NH:9][CH:10]2[c:11]1[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]1Participants
6
Sources & evidence
- ORD record
- ord-a7b7c003ab7d40718573566bbd4479cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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