Chloride → HCID 57097142, compound
Reaction equation
[CH2:1]([CH2:2][CH3:3])[O:4][c:5]1[cH:6][cH:7][c:8]([CH2:11][N:12]2[CH2:13][CH2:14][CH:15]([C:18]([OH:19])([c:20]3[cH:21][cH:22][c:23]([C:26]([F:27])([F:28])[F:29])[cH:24][cH:25]3)[c:30]3[cH:31][cH:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]3)[CH2:16][CH2:17]2)[cH:9][cH:10]1.[CH3:44][OH:45].[Cl-:43].[Na+:42].[OH:40][OH:41]>>[CH2:1]([CH2:2][CH3:3])[O:4][c:5]1[cH:6][cH:7][c:8]([CH2:11][N+:12]2([O-:40])[CH2:13][CH2:14][CH:15]([C:18]([OH:19])([c:20]3[cH:21][cH:22][c:23]([C:26]([F:27])([F:28])[F:29])[cH:24][cH:25]3)[c:30]3[cH:31][cH:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]3)[CH2:16][CH2:17]2)[cH:9][cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-7a40f77fbdbf4020af2e89ad6fe038be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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