Benzoic Acid → HCID 18919821, compound
Reaction equation
[CH2:36]([N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45])[CH3:46].[CH3:17][N:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][n:24]1)[CH3:25].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]2[CH2:9][CH2:10][CH:11]([OH:14])[CH2:12][CH2:13]2)[cH:15][cH:16]1.[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[ClH:35].[OH:26][C:27](=[O:28])[c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]2[CH2:9][CH2:10][CH:11]([O:14][C:27](=[O:26])[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[CH2:12][CH2:13]2)[cH:15][cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-f343fe27069548eba97a8e39d0596cea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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