Toluene → HCID 11688198, compound
Reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:26][O:27][CH3:28])[c:10]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[c:11]2-[c:12]1[cH:13][n:14][cH:15][c:16]([CH3:18])[cH:17]1.[CH2:30]([Al+:31][CH2:32][CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[H-:29]>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:26][O:27][CH3:28])[c:10]([CH2:19][OH:20])[c:11]2-[c:12]1[cH:13][n:14][cH:15][c:16]([CH3:18])[cH:17]1Participants
5
Sources & evidence
- ORD record
- ord-47b43c8e93be4de985b14f6989679ca0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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