Ethanol → 4-Amino-5-(4-nitrophenyl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid
Reaction equation
[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:27][CH2:28][OH:29].[NH2:1][c:2]1[n:3][cH:4][n:5][n:6]2[c:7]1[c:8](-[c:16]1[cH:17][cH:18][c:19]([N+:22](=[O:23])[O-:24])[cH:20][cH:21]1)[c:9]([C:11](=[O:12])[O:13][CH2:14][CH3:15])[cH:10]2.[Na+:26].[OH-:25]>>[NH2:1][c:2]1[n:3][cH:4][n:5][n:6]2[c:7]1[c:8](-[c:16]1[cH:17][cH:18][c:19]([N+:22](=[O:23])[O-:24])[cH:20][cH:21]1)[c:9]([C:11](=[O:12])[OH:13])[cH:10]2Participants
6
Sources & evidence
- ORD record
- ord-79dc4e1bfec74a1fbb40b5d0fffca3e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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