Acetic Acid → Cgs 22652
Reaction equation
[CH3:32][C:33]#[N:34].[CH3:37][C:38](=[O:39])[OH:40].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH:16]([CH2:17][CH2:18][C:19](=[O:20])[O:21][CH3:22])[CH2:23][CH2:24][CH2:25][c:26]2[cH:27][n:28][cH:29][cH:30][cH:31]2)[cH:6][cH:7]1.[Li+:35].[OH-:36].[OH2:41]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH:16]([CH2:17][CH2:18][C:19](=[O:20])[OH:21])[CH2:23][CH2:24][CH2:25][c:26]2[cH:27][n:28][cH:29][cH:30][cH:31]2)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-5e5c8eb24d7949faa0d5f8d76cf7aba7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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