Citric Acid → 2-Chloro-1-methyl-1H-indole-3-carbaldehyde
Reaction equation
[CH3:13][I:14].[CH3:35][S:36]([CH3:37])=[O:38].[Cl:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]1[CH:11]=[O:12].[H-:15].[Na+:16].[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1.[OH:17][C:18]([CH2:19][C:20]([C:21](=[O:22])[OH:23])([CH2:24][C:25](=[O:26])[OH:27])[OH:28])=[O:29]>>[Cl:1][c:2]1[n:3]([CH3:18])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]1[CH:11]=[O:12]Participants
8
Sources & evidence
- ORD record
- ord-1a661af77b5d4bfbaebfe5dd0ea2cf27
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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