Benzene → HCID 86587914, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:7]=[O:8])[cH:9][cH:10][c:11]1[O:12][CH3:13].[CH3:14][CH:15]([CH2:16][CH:17]([CH3:18])[NH:19][OH:20])[CH3:21].[OH2:22].[c:23]1([CH3:24])[cH:25][cH:26][c:27]([S:28]([OH:29])(=[O:30])=[O:31])[cH:32][cH:33]1.[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:7]=[N+:19]([CH:17]([CH2:16][CH:15]([CH3:14])[CH3:21])[CH3:18])[O-:20])[cH:9][cH:10][c:11]1[O:12][CH3:13]Participants
6
Sources & evidence
- ORD record
- ord-eba88b3438b448d1a3b484a0d2c21fac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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