Toluene → HCID 13589644, compound
Reaction equation
[C:1]([CH2:2][CH2:3][C:4]([CH3:6])=[O:8])([OH:5])=[O:7].[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[c:9]1(-[n:15]2[c:16]([CH2:20][CH2:21][NH2:22])[cH:17][cH:18][cH:19]2)[cH:10][cH:11][cH:12][cH:13][cH:14]1>>[C:1]1(=[O:7])[CH2:2][CH2:3][C:4]2([CH3:6])[c:17]3[c:16]([n:15](-[c:9]4[cH:10][cH:11][cH:12][cH:13][cH:14]4)[cH:19][cH:18]3)[CH2:20][CH2:21][N:22]12Participants
4
Sources & evidence
- ORD record
- ord-784221d221674431b233d86c5c979503
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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