O-Xylene → N-sec-Butyl-3,4-dimethyl-2,6-dinitroaniline
Reaction equation
[CH:16]([CH3:17])([CH2:18][CH3:19])[NH2:20].[Cl:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[c:4]([CH3:12])[c:5]([CH3:11])[cH:6][c:7]1[N+:8](=[O:9])[O-:10].[c:21]1([CH3:22])[c:23]([CH3:24])[cH:25][cH:26][cH:27][cH:28]1>>[c:2]1([NH:20][CH:16]([CH3:17])[CH2:18][CH3:19])[c:3]([N+:13](=[O:14])[O-:15])[c:4]([CH3:12])[c:5]([CH3:11])[cH:6][c:7]1[N+:8](=[O:9])[O-:10]Participants
4
Sources & evidence
- ORD record
- ord-60eea355821f4c54a0dc1d20b4e8386a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…