Acetate → HCID 314717, compound
Reaction equation
[CH2:9]=[O:10].[CH3:12][C:13](=[O:14])[O-:15].[CH3:16][n:17]1[c:18]([CH2:26][O:27][c:28]2[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]2)[cH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]12.[CH3:1][CH:2]1[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[ClH:8].[Na+:11]>>[CH3:1][CH:2]1[CH2:3][CH2:4][N:5]([CH2:12][c:19]2[c:18]([CH2:26][O:27][c:28]3[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]3)[n:17]([CH3:16])[c:25]3[c:20]2[cH:21][cH:22][cH:23][cH:24]3)[CH2:6][CH2:7]1Participants
8
Sources & evidence
- ORD record
- ord-22c69c98a4994e1bb7566f98733631ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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