Ethanol → HCID 20440412, compound
Reaction equation
[CH3:32][CH2:33][OH:34].[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5][CH:6]1[n:7]1[n:8][cH:9][c:10]2[c:11]([O:16][CH2:17][CH:18]([CH2:19][NH:20][CH2:21][CH2:22][NH:23][c:24]3[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]3)[OH:31])[cH:12][cH:13][cH:14][c:15]12>>[nH:7]1[n:8][cH:9][c:10]2[c:11]([O:16][CH2:17][CH:18]([CH2:19][NH:20][CH2:21][CH2:22][NH:23][c:24]3[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]3)[OH:31])[cH:12][cH:13][cH:14][c:15]12Participants
3
Sources & evidence
- ORD record
- ord-af36ae18510b455694e70716fdbd6a1d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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