Bicarbonate Ion → HCID 21190127, compound
Reaction equation
[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6]([CH2:10][N:11]([CH2:12][CH2:13][CH2:14][CH2:15][NH:16][S:17](=[O:18])(=[O:19])[C:20]([F:21])([F:22])[F:23])[C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:7][cH:8][cH:9]2)[cH:31]1.[CH3:44][N:45]([CH3:46])[c:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1.[CH:53]([Cl:54])([Cl:55])[Cl:56].[Cl:32][C:33]([C:34](=[O:35])[Cl:36])([Cl:37])[Cl:38].[Na+:39].[OH:40][C:41](=[O:42])[O-:43]>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6]([CH2:10][N:11]([CH2:12][CH2:13][CH2:14][CH2:15][NH:16][S:17](=[O:18])(=[O:19])[C:20]([F:21])([F:22])[F:23])[C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:7][cH:8][cH:9]2)[c:31]1[C:34]([C:33]([Cl:32])([Cl:37])[Cl:38])=[O:35]Participants
7
Sources & evidence
- ORD record
- ord-1a31f049ec6642498c09e736a10bfd31
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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