Acetate → HCID 53891326, compound
Reaction equation
[CH2:31]([OH:32])[CH3:33].[CH3:5][C:6](=[O:7])[O-:8].[Cl:9][c:10]1[c:11]([CH2:12][n:13]2[cH:14][c:15]([CH2:22][C:23]([CH3:24])=[O:25])[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]23)[cH:26][cH:27][cH:28][cH:29]1.[ClH:1].[NH2:2][OH:3].[Na+:4].[OH2:30]>>[N:2]([OH:3])=[C:23]([CH2:22][c:15]1[cH:14][n:13]([CH2:12][c:11]2[c:10]([Cl:9])[cH:29][cH:28][cH:27][cH:26]2)[c:21]2[c:16]1[cH:17][cH:18][cH:19][cH:20]2)[CH3:24]Participants
8
Sources & evidence
- ORD record
- ord-033e3a4b954442a680fba2372376bcbd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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