Benzene → HCID 54205154, compound
Reaction equation
[CH3:22][C:23]([CH3:24])=[CH:25][CH2:26][CH2:27][C:28]([CH3:29])=[CH:30][CH2:31][OH:32].[CH3:2][c:3]1[c:4]([CH2:18][C:19](=[O:20])[OH:21])[cH:5][cH:6][cH:7][c:8]1[C:9]([c:10]1[cH:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]1)=[O:17].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[Cl-:1].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH3:2][c:3]1[c:4]([CH2:18][C:19](=[O:20])[O:21][CH2:31][CH:30]=[C:28]([CH2:27][CH2:26][CH:25]=[C:23]([CH3:22])[CH3:24])[CH3:29])[cH:5][cH:6][cH:7][c:8]1[C:9]([c:10]1[cH:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]1)=[O:17]Participants
6
Sources & evidence
- ORD record
- ord-32947937c77d412e83ebe96f5fc43db7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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