Benzene → HCID 12708179, compound
Reaction equation
[N+:13]([C:14]([N+:15]([O-:16])=[O:17])=[O:18])([O-:19])=[O:20].[N+:21](=[O:22])([O-:23])[CH2:24][C:25]([CH3:26])=[O:27].[OH:28][C:29]([C:30]([F:31])([F:32])[F:33])=[O:34].[cH:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[nH:1]1[cH:2][c:3]([CH2:10][CH2:11][SH:12])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[c:2]2[c:3]([c:4]3[cH:5][cH:6][cH:7][cH:8][c:9]13)[CH2:10][CH2:11][O:27][C:25]2([CH2:24][N+:21](=[O:22])[O-:23])[CH3:26]Participants
6
Sources & evidence
- ORD record
- ord-4bbc667903944842b81378f7e85a5c96
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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