Chloride → HCID 9933828, compound
Reaction equation
[Al+3:2].[Al+3:6].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH:11]([CH3:12])([CH3:13])[c:14]1[cH:15][cH:16][c:17]([CH:20]2[C:21]([CH3:44])([CH3:45])[O:22][c:23]3[c:24]2[c:25]([CH3:43])[c:26]([NH:31][C:32]([CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)=[O:42])[c:27]([CH3:30])[c:28]3[CH3:29])[cH:18][cH:19]1.[Cl-:1].[Cl-:3].[Cl-:4].[H-:10].[H-:5].[H-:8].[H-:9].[Li+:7].[Na+:47].[OH-:46]>>[CH:11]([CH3:12])([CH3:13])[c:14]1[cH:15][cH:16][c:17]([CH:20]2[C:21]([CH3:44])([CH3:45])[O:22][c:23]3[c:24]2[c:25]([CH3:43])[c:26]([NH:31][CH2:32][CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)[c:27]([CH3:30])[c:28]3[CH3:29])[cH:18][cH:19]1Participants
9
Sources & evidence
- ORD record
- ord-3c24be7d72ed4a478a980fab3199fbba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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