Ethanol → HCID 13913229, compound
Reaction equation
[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[CH3:30][CH2:31][OH:32].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[CH:8]([O:11][CH3:12])[CH2:9][CH2:10]2.[NH2:13][c:14]1[cH:15][cH:16][c:17]([C:18]#[N:19])[cH:20][cH:21]1.[Na+:23].[OH-:22]>>[c:2]1([NH:13][c:14]2[cH:15][cH:16][c:17]([C:18]#[N:19])[cH:20][cH:21]2)[c:3]2[c:4]([n:5][cH:6][n:7]1)[CH:8]([O:11][CH3:12])[CH2:9][CH2:10]2Participants
7
Sources & evidence
- ORD record
- ord-3a05cf7732ea438585e3bdd24b96dcb8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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