Ethanol → HCID 67407046, compound
Reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:50][CH2:51][OH:52].[Cl:1][C:2](=[O:3])[O:4][C:5]([Cl:6])([Cl:7])[Cl:8].[O:27]1[CH2:28][CH2:29][N:30]([CH2:33][c:34]2[c:35]([C:41]([F:42])([F:43])[F:44])[cH:36][c:37]([NH2:40])[cH:38][cH:39]2)[CH2:31][CH2:32]1.[O:9]1[CH2:10][CH2:11][NH:12][c:13]2[c:14]1[cH:15][c:16]([O:19][c:20]1[n:21][c:22]([NH2:26])[n:23][cH:24][cH:25]1)[cH:17][cH:18]2>>[C:2](=[O:3])([N:12]1[CH2:11][CH2:10][O:9][c:14]2[c:13]1[cH:18][cH:17][c:16]([O:19][c:20]1[n:21][c:22]([NH2:26])[n:23][cH:24][cH:25]1)[cH:15]2)[NH:40][c:37]1[cH:36][c:35]([C:41]([F:42])([F:43])[F:44])[c:34]([CH2:33][N:30]2[CH2:29][CH2:28][O:27][CH2:32][CH2:31]2)[cH:39][cH:38]1Participants
6
Sources & evidence
- ORD record
- ord-1edea3f2b4ee49f78bcd9daab8314516
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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