Bicarbonate Ion → HCID 86646946, compound
Reaction equation
[C:47](=[O:48])([O-:49])[OH:50].[CH3:55][C:56]#[N:57].[Cl:52][CH2:53][Cl:54].[Cl:8][c:9]1[c:10]([CH:17]([CH3:18])[O:19][c:20]2[cH:21][c:22]3[c:23]([n:24][c:25]([NH:27][C:28]([CH2:29][N:30]4[CH2:31][CH2:32][N:33]([C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])[CH2:34][CH2:35]4)=[O:43])[s:26]3)[cH:44][c:45]2[F:46])[c:11]([Cl:16])[cH:12][cH:13][c:14]1[F:15].[Na+:51].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[Cl:8][c:9]1[c:10]([CH:17]([CH3:18])[O:19][c:20]2[cH:21][c:22]3[c:23]([n:24][c:25]([NH:27][C:28]([CH2:29][N:30]4[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]4)=[O:43])[s:26]3)[cH:44][c:45]2[F:46])[c:11]([Cl:16])[cH:12][cH:13][c:14]1[F:15]Participants
7
Sources & evidence
- ORD record
- ord-20d57a2273564d59aa256c5f6d3dccac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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