Acetate → HCID 68325445, compound
Reaction equation
[CH3:36][C:37](=[O:38])[O-:39].[CH3:43][OH:44].[Cl:1][c:2]1[cH:3][c:4]([CH:22]2[O:23][CH2:24][CH2:25][N:26]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[CH2:27]2)[cH:5][cH:6][c:7]1[N:8]=[C:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[ClH:40].[NH2:41][OH:42].[Na+:35]>>[Cl:1][c:2]1[cH:3][c:4]([CH:22]2[O:23][CH2:24][CH2:25][N:26]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[CH2:27]2)[cH:5][cH:6][c:7]1[NH2:8]Participants
7
Sources & evidence
- ORD record
- ord-f44303465a8c4b8c8b3fbf56ec67bc83
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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