Hydrochloric Acid → HCID 15457067, compound
Reaction equation
[CH3:1][n:2]1[c:3](=[O:22])[c:4](-[c:12]2[c:13]([F:21])[cH:14][c:15]([Cl:20])[c:16]([CH:17]=[O:18])[cH:19]2)[cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[ClH:23].[Mg+2:26].[NH2:24][OH:25].[O-:27][S:28](=[O:29])(=[O:30])[O-:31].[OH2:51].[c:32]1([CH3:33])[cH:34][cH:35][c:36]([S:37]([OH:38])(=[O:39])=[O:40])[cH:41][cH:42]1.[c:43]1([CH3:44])[c:45]([CH3:46])[cH:47][cH:48][cH:49][cH:50]1>>[CH3:1][n:2]1[c:3](=[O:22])[c:4](-[c:12]2[c:13]([F:21])[cH:14][c:15]([Cl:20])[c:16]([C:17]#[N:24])[cH:19]2)[cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]Participants
9
Sources & evidence
- ORD record
- ord-017d96bf9ffb4fad9c7a2f622df29c44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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