Isopropanol → HCID 57920196, compound
Reaction equation
[CH3:1][N:2]([C:3]([O:4][c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[C:14]2([O:20][CH2:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]2)[cH:8][cH:9][cH:10]1)=[O:28])[CH3:29].[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[CH:50]([OH:51])([CH3:52])[CH3:53].[Cl:39][c:40]1[c:41]2[c:42]([n:43][cH:44][n:45]1)[nH:46][cH:47][c:48]2[CH3:49]>>[CH3:1][N:2]([C:3]([O:4][c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[C:14]2([O:20][CH2:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[CH2:15][CH2:16][N:17]([c:40]3[c:41]4[c:42]([n:43][cH:44][n:45]3)[nH:46][cH:47][c:48]4[CH3:49])[CH2:18][CH2:19]2)[cH:8][cH:9][cH:10]1)=[O:28])[CH3:29]Participants
5
Sources & evidence
- ORD record
- ord-6bc0557fb9c7459bbfc534d7f27a97b7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…