Isopropanol → HCID 59314302, compound
Reaction equation
[CH2:39]([CH3:40])[O:41][C:42](=[O:43])[C:44]1([NH2:53])[CH2:45][c:46]2[cH:47][cH:48][cH:49][cH:50][c:51]2[CH2:52]1.[CH:54]([N:55]([CH2:56][CH3:57])[CH:58]([CH3:59])[CH3:60])([CH3:61])[CH3:62].[CH:63]([OH:64])([CH3:65])[CH3:66].[Cl:67][CH2:68][Cl:69].[Cl:70][CH2:71][Cl:72].[O:1]([C:2](=[O:3])[CH3:4])[c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][c:13]1[CH3:14].[P-:15]([F:16])([F:17])([F:18])([F:19])([F:20])[F:21].[n:22]1([O:23][C:24]([N:25]([CH3:26])[CH3:27])=[N+:28]([CH3:29])[CH3:30])[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[n:37][n:38]1>>[O:1]([C:2](=[O:3])[CH3:4])[c:5]1[c:6]([C:7](=[O:9])[NH:53][C:44]2([C:42]([O:41][CH2:39][CH3:40])=[O:43])[CH2:45][c:46]3[cH:47][cH:48][cH:49][cH:50][c:51]3[CH2:52]2)[cH:10][cH:11][cH:12][c:13]1[CH3:14]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-5a40bc8b41044f76bd3201483e1859d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…