Acetate → HCID 23081124, compound
Reaction equation
[CH3:29][C:30](=[O:31])[O-:32].[CH3:33][CH2:34][OH:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([O:10][CH2:11][C:12]2([CH3:15])[O:13][CH2:14]2)=[O:16])[cH:6][cH:7]1.[N+:17]([O-:18])(=[O:19])[c:20]1[nH:21][cH:22][c:23]([N+:25](=[O:26])[O-:27])[n:24]1.[Na+:28]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9]([O:10][CH2:11][C:12]2([CH3:15])[O:13][c:20]3[n:21]([cH:22][c:23]([N+:25](=[O:26])[O-:27])[n:24]3)[CH2:14]2)=[O:16])[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-9bf7ded1b3dd4ec39e64f505731ed3f6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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