Benzene → HCID 66899805, compound
Reaction equation
[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[CH:1]1([CH2:6][CH:7]([C:8](=[O:9])[OH:10])[N:11]2[C:12](=[O:18])[CH:13]=[C:14]([O:16][CH3:17])[CH2:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[Cl:51][CH2:52][Cl:53].[NH2:25][c:26]1[n:27][n:28]([CH2:31][C:32]([CH3:33])([OH:34])[CH3:35])[cH:29][cH:30]1.[cH:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[CH:1]1([CH2:6][CH:7]([C:8](=[O:10])[NH:25][c:26]2[n:27][n:28]([CH2:31][C:32]([CH3:33])([OH:34])[CH3:35])[cH:29][cH:30]2)[N:11]2[C:12](=[O:18])[CH:13]=[C:14]([O:16][CH3:17])[CH2:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
8
Sources & evidence
- ORD record
- ord-44ef49df75e0446a98b40f2f12ffafec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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