Acetate → HCID 58063524, compound
Reaction equation
[C:38](=[O:39])([O-:40])[O-:41].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][n:10][n:11]([CH:13]3[C:14](=[O:30])[N:15]([CH2:25][C:26]([F:27])([F:28])[F:29])[c:16]4[c:17]([c:20]([F:24])[cH:21][cH:22][cH:23]4)[CH2:18][CH2:19]3)[cH:12]2)[cH:5][cH:6][cH:7]1.[Cs+:42].[Cs+:43].[NH2:31][c:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1.[O-:51][C:52]([CH3:53])=[O:54].[O-:55][C:56]([CH3:57])=[O:58].[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1.[Pd+2:50]>>[c:2]1([NH:31][c:32]2[cH:33][cH:34][n:35][cH:36][cH:37]2)[cH:3][c:4](-[c:8]2[n:9][n:10][n:11]([CH:13]3[C:14](=[O:30])[N:15]([CH2:25][C:26]([F:27])([F:28])[F:29])[c:16]4[c:17]([c:20]([F:24])[cH:21][cH:22][cH:23]4)[CH2:18][CH2:19]3)[cH:12]2)[cH:5][cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-a16fb644233f4bee8d4670093a75f17a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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