Hydrochloric Acid → 3-hydroxy-3-isopropylaminomethyl-7-nitro-3,4-dihydro-2H-1,5-benzodioxepin
Reaction equation
[CH:1]([CH3:2])([CH3:3])[N:4]1[C:5](=[O:22])[O:6][C:7]2([CH2:8]1)[CH2:9][O:10][c:11]1[c:12]([cH:15][cH:16][c:17]([N+:19](=[O:20])[O-:21])[cH:18]1)[O:13][CH2:14]2.[ClH:25].[K+:24].[Na+:27].[O:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34]1.[OH-:23].[OH-:26].[OH2:28]>>[CH:1]([CH3:2])([CH3:3])[NH:4][CH2:8][C:7]1([OH:6])[CH2:9][O:10][c:11]2[c:12]([cH:15][cH:16][c:17]([N+:19](=[O:20])[O-:21])[cH:18]2)[O:13][CH2:14]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-3bf26b0da6a24a1f8e9a6aebddc14aa9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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