Chloride → HCID 23156129, compound
Reaction equation
[Al+3:38].[Al+3:44].[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([NH:21][CH:22]2[CH2:23][CH2:24][CH:25]([C:28](=[O:29])[N:30]3[CH2:31][CH2:32][N:33]([CH3:36])[CH2:34][CH2:35]3)[CH2:26][CH2:27]2)[cH:19][cH:20]1.[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[Cl-:43].[Cl-:45].[Cl-:46].[H-:37].[H-:40].[H-:41].[H-:42].[Li+:39].[Na+:48].[OH-:47]>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([NH:21][CH:22]2[CH2:23][CH2:24][CH:25]([CH2:28][N:30]3[CH2:31][CH2:32][N:33]([CH3:36])[CH2:34][CH2:35]3)[CH2:26][CH2:27]2)[cH:19][cH:20]1Participants
9
Sources & evidence
- ORD record
- ord-dca93acfe5a2476c9acdea06c32c56de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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