Acetic Acid → HCID 11646308, compound
Reaction equation
[CH3:27][N:28]1[CH2:29][CH2:30][N:31]([CH3:32])[C:33]1=[O:34].[CH3:36][C:37](=[O:38])[OH:39].[F:1][c:2]1[cH:3][c:4]2[c:5](=[O:21])[n:6]([NH:16][S:17](=[O:18])(=[O:19])[CH3:20])[c:7](=[O:15])[nH:8][c:9]2[cH:10][c:11]1[N+:12](=[O:13])[O-:14].[OH2:35].[nH:22]1[cH:23][n:24][cH:25][cH:26]1>>[c:2]1(-[n:22]2[cH:23][n:24][cH:25][cH:26]2)[cH:3][c:4]2[c:5](=[O:21])[n:6]([NH:16][S:17](=[O:18])(=[O:19])[CH3:20])[c:7](=[O:15])[nH:8][c:9]2[cH:10][c:11]1[N+:12](=[O:13])[O-:14]Participants
6
Sources & evidence
- ORD record
- ord-491c378567e04cfc9ddaccff5594a10d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…