Acetate → HCID 86600617, compound
Reaction equation
[CH3:33][C:34](=[O:35])[O-:36].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[CH3:50][CH2:51][OH:52].[CH3:53][C:54](=[O:55])[OH:56].[Cl:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][NH:26][C:27]([CH2:28][C:29]#[N:30])=[O:31])[cH:23][n:24]1.[ClH:12].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([NH2:7])[cH:8][cH:9]1)([F:10])[F:11].[Na+:13].[Na+:32].[Na+:37].[Na+:38].[O-:14][N+:15](=[O:16])[O-:17].[O-:39][C:40](=[O:41])[O-:42].[OH2:43]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([NH:7][N:15]=[C:28]([C:27]([NH:26][CH2:25][c:22]2[cH:21][cH:20][c:19]([Cl:18])[n:24][cH:23]2)=[O:31])[C:29]#[N:30])[cH:8][cH:9]1)([F:10])[F:11]Participants
12
Sources & evidence
- ORD record
- ord-1d0f23ba00344b8a82502b8193b6666d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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