Toluene → HCID 69589326, compound
Reaction equation
[CH2:37]([P:38]([CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH3:49].[CH3:23][O:24][C:25]([CH2:26][CH2:27][c:28]1[c:29]([CH3:35])[cH:30][c:31]([OH:34])[cH:32][cH:33]1)=[O:36].[CH3:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6](-[c:12]2[cH:13][cH:14][c:15]([O:18][C:19]([F:20])([F:21])[F:22])[cH:16][cH:17]2)[o:7][c:8]1[CH:9]([CH3:10])[OH:11].[N:50]([C:51]([N:52]1[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]1)=[O:58])=[N:59][C:60]([N:61]1[CH2:62][CH2:63][CH2:64][CH2:65][CH2:66]1)=[O:67]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6](-[c:12]2[cH:13][cH:14][c:15]([O:18][C:19]([F:20])([F:21])[F:22])[cH:16][cH:17]2)[o:7][c:8]1[CH:9]([CH3:10])[O:11][c:31]1[cH:30][c:29]([CH3:35])[c:28]([CH2:27][CH2:26][C:25]([O:24][CH3:23])=[O:36])[cH:33][cH:32]1Participants
6
Sources & evidence
- ORD record
- ord-be616cc1f42c460b8ae03ee3c9bce9c8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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