Phenol → HCID 178449425, compound
Reaction equation
[CH3:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[O:68]=[C:69]([O:70][CH:71]([CH3:72])[CH3:73])[N:74]=[N:75][C:76]([O:77][CH:78]([CH3:79])[CH3:80])=[O:81].[OH:1][CH2:2][c:3]1[c:4]([C:14](=[O:15])[N:16]([CH:17]2[CH2:18][N:19]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:20][CH:21]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:22]2)[CH2:38][CH:39]([CH3:40])[CH3:41])[n:5][n:6][n:7]1-[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[OH:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[c:49]1([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[O:1]([CH2:2][c:3]1[c:4]([C:14](=[O:15])[N:16]([CH:17]2[CH2:18][N:19]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:20][CH:21]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:22]2)[CH2:38][CH:39]([CH3:40])[CH3:41])[n:5][n:6][n:7]1-[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1Participants
6
Sources & evidence
- ORD record
- ord-51694ea9cce8494e90beba91ce49ef03
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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