Benzene → HCID 178448409, compound
Reaction equation
[CH3:1][C:2]([CH:3]([C:4](=[O:5])[O:6][CH:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[N:20]1[CH:21]2[O:22][C:23]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)=[N:24][CH:25]2[C:26]1=[O:27])=[CH2:34].[O:35]=[Ca:36].[S:37]([Cl:38])(=[O:39])([Cl:40])=[O:41].[cH:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH2:1]([C:2]([CH:3]([C:4](=[O:5])[O:6][CH:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[N:20]1[CH:21]2[O:22][C:23]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)=[N:24][CH:25]2[C:26]1=[O:27])=[CH2:34])[Cl:40]Participants
5
Sources & evidence
- ORD record
- ord-cb06747c3b1d4a75bf501791b20c01df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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