Acetate → HCID 178465689, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:11]([C:14]([CH3:15])=[O:16])[CH2:12][CH2:13]1.[CH3:28][C:29](=[O:30])[O-:31].[CH3:32][CH2:33][OH:34].[ClH:26].[NH2:24][OH:25].[Na+:27].[OH2:35]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:11]([C:14]([CH3:15])=[N:24][OH:25])[CH2:12][CH2:13]1Participants
8
Sources & evidence
- ORD record
- ord-bd4b62efd80544bdb3cdbddfaea7fa42
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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