Calcium Cation → HCID 15754349, compound
Reaction equation
[CH2:1]([CH3:2])[I:3].[CH3:9][C:10]#[N:11].[Ca+2:4].[Cl:12][c:13]1[cH:14][c:15]([C:16]([CH3:17])([CH3:18])[N:19]2[C:20](=[O:31])[C:21]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)=[C:22]([CH3:24])[CH2:23]2)[cH:32][c:33]([Cl:36])[c:34]1[OH:35].[O-:5][C:6](=[O:7])[O-:8].[OH2:37]>>[CH2:1]([CH3:2])[O:35][c:34]1[c:13]([Cl:12])[cH:14][c:15]([C:16]([CH3:17])([CH3:18])[N:19]2[C:20](=[O:31])[C:21]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)=[C:22]([CH3:24])[CH2:23]2)[cH:32][c:33]1[Cl:36]Participants
7
Sources & evidence
- ORD record
- ord-23ba14af810e4d4a9e9763513c69c227
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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