Acetic Acid → HCID 20137755, compound
Reaction equation
[CH2:35]([Cl:36])[Cl:37].[CH3:15][Al:16]([CH3:17])[CH3:18].[CH3:19][O:20][c:21]1[n:22][c:23]([NH:29][C:30]([O:31][CH3:33])=[O:32])[n:24][c:25]([O:27][CH3:28])[n:26]1.[CH3:38][C:39](=[O:40])[OH:41].[ClH:34].[OH2:42].[S:1]1[CH2:2][CH2:3][S:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][c:10]2[S:11](=[O:12])(=[O:13])[NH2:14]>>[S:1]1[CH2:2][CH2:3][S:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][c:10]2[S:11](=[O:12])(=[O:13])[NH:14][C:30]([NH:29][c:23]1[n:22][c:21]([O:20][CH3:19])[n:26][c:25]([O:27][CH3:28])[n:24]1)=[O:31]Participants
8
Sources & evidence
- ORD record
- ord-d0eda827f03443e2abd5cd889ecff3f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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