Ethanol → HCID 66733850, compound
Reaction equation
[CH3:21][CH2:22][OH:23].[Cl:31][CH2:32][Cl:33].[O:1]1[CH2:3][CH2:2][O:4][C:5]12[CH2:6][CH2:7][CH:8]([c:11]1[n:12][c:13]3[n:14]([c:15]([NH2:17])[cH:16]1)[n:18][cH:19][cH:20]3)[CH2:9][CH2:10]2.[O:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1.[OH2:24]>>[O:4]=[C:5]1[CH2:6][CH2:7][CH:8]([c:11]2[n:12][c:13]3[n:14]([c:15]([NH2:17])[cH:16]2)[n:18][cH:19][cH:20]3)[CH2:9][CH2:10]1Participants
6
Sources & evidence
- ORD record
- ord-788948606bfa414c8d0eeb4e76a2ec96
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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