Benzoic Acid → HCID 178471655, compound
Reaction equation
[C:43]([P:44](=[O:45])([O:46][CH2:47][CH3:48])[O:49][CH2:50][CH3:51])#[N:52].[CH2:29]([CH3:30])[O:31][C:32]([CH:33]([NH2:34])[CH2:35][CH2:36][C:37](=[O:38])[O:39][CH2:40][CH3:41])=[O:42].[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][c:7]3[c:8]([c:9]2[c:10](=[O:12])[nH:11]1)[cH:13][c:14]([CH2:17][O:18][c:19]1[cH:20][cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:26][cH:27]1)[cH:15][cH:16]3.[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[ClH:28].[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[OH:60][C:61]([c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)=[O:68]>>[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][c:7]3[c:8]([c:9]2[c:10](=[O:12])[nH:11]1)[cH:13][c:14]([CH2:17][O:18][c:19]1[cH:20][cH:21][c:22]([C:23](=[O:24])[NH:34][CH:33]([C:32]([O:31][CH2:29][CH3:30])=[O:42])[CH2:35][CH2:36][C:37](=[O:38])[O:39][CH2:40][CH3:41])[cH:26][cH:27]1)[cH:15][cH:16]3Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-432b1e624c40468d95b362c2d73dbdc5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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