Toluene → HCID 59580742, compound
Reaction equation
[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][c:2]1[s:3][c:4]([C:8](=[O:9])[OH:10])[c:5]([Cl:7])[n:6]1.[c:18]1([P:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)(=[O:26])[N:32]=[N+:33]=[N-:34])[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[s:3][c:4]([C:8](=[O:10])[N:32]=[N+:33]=[N-:34])[c:5]([Cl:7])[n:6]1Participants
5
Sources & evidence
- ORD record
- ord-b068b824782e4074b7322fe26c2a35c0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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