Ethanol → HCID 178473790, compound
Reaction equation
[C:38](=[O:39])([O-:40])[O-:41].[CH3:44][CH2:45][OH:46].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:32]3[n:33][cH:34][n:35][cH:36][cH:37]3)[c:10]([CH:23]3[CH2:24][CH2:25][N:26]([C:29]([CH3:30])=[O:31])[CH2:27][CH2:28]3)[n:11][n:12]2[S:13]([c:14]2[cH:15][cH:16][c:17]([CH3:18])[cH:19][cH:20]2)(=[O:21])=[O:22])[cH:6][cH:7]1.[K+:42].[K+:43]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:32]3[n:33][cH:34][n:35][cH:36][cH:37]3)[c:10]([CH:23]3[CH2:24][CH2:25][N:26]([C:29]([CH3:30])=[O:31])[CH2:27][CH2:28]3)[n:11][nH:12]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-9540b24bba234be980f5620d49ecef67
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…