Benzene → HCID 85040011, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[O:9])[cH:10][cH:11]1.[CH:12]1([NH:18][OH:19])[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1.[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[N+:18]([CH:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[O-:19])[cH:10][cH:11]1Participants
5
Sources & evidence
- ORD record
- ord-98f8e70a2aa5477c9ffb2f639f86706d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…