Potassium Cation → 1-[(Diethoxyphosphoryl)methyl]-8-nitro-7-trifluoromethyl[1,2,4]triazolo[4,3-a]quinoxalin-4(5H)-one
Reaction equation
[CH2:6]([CH3:7])[O:8][P:9](=[O:10])([O:11][CH2:12][CH3:13])[CH2:14][c:15]1[n:16][n:17][c:18]2[n:19]1[c:20]1[cH:21][cH:22][c:23]([C:29]([F:30])([F:31])[F:32])[cH:24][c:25]1[nH:26][c:27]2=[O:28].[K+:1].[O-:2][N+:3]([O-:4])=[O:5].[S:33](=[O:34])(=[O:35])([OH:36])[OH:37]>>[O-:2][N+:3](=[O:5])[c:22]1[cH:21][c:20]2[n:19]3[c:15]([CH2:14][P:9]([O:8][CH2:6][CH3:7])(=[O:10])[O:11][CH2:12][CH3:13])[n:16][n:17][c:18]3[c:27](=[O:28])[nH:26][c:25]2[cH:24][c:23]1[C:29]([F:30])([F:31])[F:32]Participants
5
Sources & evidence
- ORD record
- ord-68fe7ded795043ec918d1dfd1c02b678
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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