Toluene → HCID 22929666, compound
Reaction equation
[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[CH:29]1([c:32]2[cH:33][cH:34][c:35]([CH2:38][OH:39])[cH:36][n:37]2)[CH2:30][CH2:31]1.[N:18]12[CH2:19][CH2:20][CH2:21][N:22]=[C:23]1[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]2.[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)(=[O:9])[N:15]=[N+:16]=[N-:17])[cH:10][cH:11][cH:12][cH:13][cH:14]1>>[N:15](=[N+:16]=[N-:17])[CH2:38][c:35]1[cH:34][cH:33][c:32]([CH:29]2[CH2:30][CH2:31]2)[n:37][cH:36]1Participants
6
Sources & evidence
- ORD record
- ord-3dc8f725857549e49b3f645147476c3b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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