Benzene → HCID 72816255, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[O:9])[cH:10][c:11]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:12]1[O:13][CH2:14][O:15][CH3:16].[C:21]([CH3:22])([CH3:23])([CH3:24])[NH:25][OH:26].[cH:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[N+:25]([C:21]([CH3:22])([CH3:23])[CH3:24])[O-:26])[cH:10][c:11]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:12]1[O:13][CH2:14][O:15][CH3:16]Participants
4
Sources & evidence
- ORD record
- ord-523eceabe640404fbc4afcc06c193f76
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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