Toluene → HCID 14405661, compound
Reaction equation
[CH2:5]1[NH:6][CH2:7][CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21.[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[c:15]1([CH2:21][N:22]2[CH2:23][CH2:24][CH:25]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[CH2:26][CH2:27]2)[cH:16][cH:17][cH:18][cH:19][cH:20]1>>[CH2:5]1[N:6]([C:28]([CH:25]2[CH2:24][CH2:23][N:22]([CH2:21][c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[CH2:27][CH2:26]2)=[O:29])[CH2:7][CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21Participants
6
Sources & evidence
- ORD record
- ord-34ba3a2a823041c2b2166c101bafb670
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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