Acetic Acid → HCID 178508947, compound
Reaction equation
[CH3:34][C:35]([CH3:36])([O-:37])[CH3:38].[CH3:40][C:41]([CH3:42])([O-:43])[CH3:44].[CH3:51][C:52](=[O:53])[OH:54].[Cl-:17].[F:1][C:2]([C:3](=[O:4])[NH:5][CH2:6][c:7]1[cH:8][c:9]([CH2:13][OH:14])[cH:10][cH:11][cH:12]1)([F:15])[F:16].[K+:39].[NH2:18][c:19]1[n:20][c:21]([N+:28]2([CH3:29])[CH2:30][CH2:31][CH2:32][CH2:33]2)[c:22]2[nH:23][cH:24][n:25][c:26]2[n:27]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH2:50]>>[F:1][C:2]([C:3](=[O:4])[NH:5][CH2:6][c:7]1[cH:8][c:9]([CH2:13][O:14][c:21]2[n:20][c:19]([NH2:18])[n:27][c:26]3[c:22]2[n:23][cH:24][nH:25]3)[cH:10][cH:11][cH:12]1)([F:15])[F:16]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-a066c06683914d52aba781af1c5f7047
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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