Toluene → HCID 58460146, compound
Reaction equation
[CH2:22]([CH3:23])[O:24][C:25](=[O:26])[CH:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[C:33](=[O:34])[O:35][CH2:36][CH3:37].[CH3:38][P:39]([CH3:40])[CH3:41].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[CH3:63][CH:64]1[CH2:65][CH2:66][CH2:67][O:68]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][n:9]2[c:10]([C:18]([CH3:19])([CH3:20])[CH3:21])[n:11][c:12]3[c:13]2[CH:14]([OH:17])[CH2:15][CH2:16]3)[cH:6][cH:7]1.[O:42]=[C:43]([O:44][CH:45]([CH3:46])[CH3:47])[N:48]=[N:49][C:50]([O:51][CH:52]([CH3:53])[CH3:54])=[O:55]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][n:9]2[c:10]([C:18]([CH3:19])([CH3:20])[CH3:21])[n:11][c:12]3[c:13]2[CH:14]([C:27]([C:25]([O:24][CH2:22][CH3:23])=[O:26])([C:28](=[O:29])[O:30][CH2:31][CH3:32])[C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:15][CH2:16]3)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-a0c4e2f69712459a8bc8ab0ac14ab4bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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