Sodium ion → HCID 19082079, compound
Reaction equation
[CH3:33][O:34][CH2:35][CH2:36][O:37][CH3:38].[CH3:47][O:48][CH:49]([O:50][CH3:51])[CH3:52].[Cl:1][c:2]1[c:3]([CH2:29][CH3:30])[n:4][cH:5][cH:6][c:7]1[NH:8][C:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[n:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[cH:15][cH:16]1)=[O:28].[Cl:39][C:40](=[O:41])[O:42][CH2:43][CH:44]([CH3:45])[CH3:46].[H-:31].[Na+:32].[OH2:53]>>[Cl:1][c:2]1[c:3]([CH2:29][CH3:30])[n:4][cH:5][cH:6][c:7]1[N:8]([C:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[n:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[cH:15][cH:16]1)=[O:28])[C:40](=[O:41])[O:42][CH2:43][CH:44]([CH3:45])[CH3:46]Participants
8
Sources & evidence
- ORD record
- ord-76f0b17205d4419f89bfc5f33ac391bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…