Acetate → HCID 59644537, compound
Reaction equation
[CH3:43][C:44](=[O:45])[O:46][C:47](=[O:48])[CH3:49].[CH3:51][C:52](=[O:53])[O-:54].[NH2:1][c:2]1[c:3]([C:34](=[O:35])[c:36]2[c:37]([Cl:42])[cH:38][cH:39][cH:40][cH:41]2)[c:4](-[c:8]2[n:9][n:10][n:11]([CH2:19][c:20]3[cH:21][c:22]([C:30]([F:31])([F:32])[F:33])[cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[c:12]2-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[n:5][cH:6][cH:7]1.[Na+:50]>>[NH:1]([c:2]1[c:3]([C:34](=[O:35])[c:36]2[c:37]([Cl:42])[cH:38][cH:39][cH:40][cH:41]2)[c:4](-[c:8]2[n:9][n:10][n:11]([CH2:19][c:20]3[cH:21][c:22]([C:30]([F:31])([F:32])[F:33])[cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[c:12]2-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[n:5][cH:6][cH:7]1)[C:44]([CH3:43])=[O:45]Participants
5
Sources & evidence
- ORD record
- ord-0451b3221e1c41dfaa189b2faa7007ef
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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