Acetic Acid → HCID 68804327, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([NH:5][c:6]1[cH:7][c:8]2[cH:9][cH:10][c:11]([O:16][C:17]([CH3:18])=[O:19])[cH:12][c:13]2[cH:14][cH:15]1)=[O:20].[CH3:30][C:31](=[O:32])[OH:33].[Cl:21][N:22]1[C:23](=[O:24])[CH2:25][CH2:26][C:27]1=[O:28].[ClH:29]>>[CH2:1]([CH3:2])[O:3][C:4]([NH:5][c:6]1[c:7]([Cl:21])[c:8]2[cH:9][cH:10][c:11]([O:16][C:17]([CH3:18])=[O:19])[cH:12][c:13]2[cH:14][cH:15]1)=[O:20]Participants
5
Sources & evidence
- ORD record
- ord-420ba341570540c18e34ab6a69f4e0e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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