Chloride → HCID 10309469, compound
Reaction equation
[CH2:39]([N+:40]([CH2:41][CH3:42])([CH2:43][CH3:44])[CH2:45][CH3:46])[c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:2][N:3]([CH2:4][CH2:5][Cl:6])[CH3:7].[CH3:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1.[Cl-:38].[Cl:15][c:16]1[cH:17][cH:18][c:19]2[c:20]([cH:35]1)-[c:21]1[c:22]([CH2:33][OH:34])[s:23][cH:24][c:25]1-[c:26]1[c:27]([cH:29][cH:30][cH:31][cH:32]1)[O:28]2.[ClH:1].[Na+:37].[OH-:36].[OH2:53]>>[CH3:2][N:3]([CH2:4][CH2:5][O:34][CH2:33][c:22]1[c:21]2[c:25]([cH:24][s:23]1)-[c:26]1[c:27]([cH:29][cH:30][cH:31][cH:32]1)[O:28][c:19]1[cH:18][cH:17][c:16]([Cl:15])[cH:35][c:20]1-2)[CH3:7]Participants
10
Sources & evidence
- ORD record
- ord-e1565fc3da8a4bacba399db22a5c5d98
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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