Hydrochloric Acid → HCID 22311998, compound
Reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH:15]2[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][CH2:23][n:24]3[n:25][c:26](-[c:37]4[cH:38][cH:39][c:40]([C:43]([F:44])([F:45])[F:46])[cH:41][cH:42]4)[c:27]4[c:32]3[CH2:31][CH2:30][N:29]([S:33](=[O:34])(=[O:35])[CH3:36])[CH2:28]4)[CH2:19][CH2:20]2)[c:7]2[c:8]([s:9]1)[cH:10][c:11]([F:14])[cH:12][cH:13]2.[ClH:49].[K+:48].[OH-:47].[OH2:55]>>[O:2]=[C:3]([OH:4])[c:5]1[c:6]([CH:15]2[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][CH2:23][n:24]3[n:25][c:26](-[c:37]4[cH:38][cH:39][c:40]([C:43]([F:44])([F:45])[F:46])[cH:41][cH:42]4)[c:27]4[c:32]3[CH2:31][CH2:30][N:29]([S:33](=[O:34])(=[O:35])[CH3:36])[CH2:28]4)[CH2:19][CH2:20]2)[c:7]2[c:8]([s:9]1)[cH:10][c:11]([F:14])[cH:12][cH:13]2Participants
7
Sources & evidence
- ORD record
- ord-f347ab5695a844e4becf02dd0de97c88
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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