Benzoic Acid → HCID 85095010, compound
Reaction equation
[CH2:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH:1](=[O:2])[c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([O:15][C:16]([F:17])([F:18])[F:19])[cH:11][cH:12][cH:13][cH:14]2)[cH:7][cH:8]1.[OH2:49].[OH:33][C:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)=[O:41].[S:20]1[C:21](=[O:26])[NH:22][C:23](=[O:25])[CH2:24]1>>[CH:1]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([O:15][C:16]([F:17])([F:18])[F:19])[cH:11][cH:12][cH:13][cH:14]2)[cH:7][cH:8]1)=[C:24]1[S:20][C:21](=[O:26])[NH:22][C:23]1=[O:25]Participants
7
Sources & evidence
- ORD record
- ord-926380fd4f914087b62cc9a8db33d82b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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