Ethanol → HCID 86623346, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[cH:11][c:12]([NH2:18])[cH:13][cH:14][c:15]2[CH2:16][CH2:17]1.[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:35][CH2:36][OH:37].[Cl:24][c:25]1[n:26][cH:27][c:28]([N+:32](=[O:33])[O-:34])[c:29]([Cl:31])[cH:30]1.[Na+:23].[O-:19][C:20]([OH:21])=[O:22]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[cH:11][c:12]([NH:18][c:29]3[c:28]([N+:32](=[O:33])[O-:34])[cH:27][n:26][c:25]([Cl:24])[cH:30]3)[cH:13][cH:14][c:15]2[CH2:16][CH2:17]1Participants
7
Sources & evidence
- ORD record
- ord-98510319d6f540d19a7aec83ed6df1c6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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