Benzene → HCID 22036735, compound
Reaction equation
[C:28](=[O:29])([OH:30])[O-:31].[CH3:39][N:40]([c:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1)[CH3:47].[Cl:22][CH2:23][CH2:24][C:25](=[O:26])[Cl:27].[NH2:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:7]3[c:8]([nH:9][c:10]12)[CH2:11][CH2:12][N:13]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:14]3.[Na+:32].[cH:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][c:6]2[c:7]3[c:8]([nH:9][c:10]12)[CH2:11][CH2:12][N:13]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:14]3)[C:25]([CH2:24][CH2:23][Cl:22])=[O:26]Participants
7
Sources & evidence
- ORD record
- ord-6e8601a43d9b4066a6ca0e4b9212fb4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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