Acetonitrile → 3-CHLORO-4-NITRO-1H-INDOLE
Reaction equation
[CH2:24]([Cl:25])[Cl:26].[CH3:21][C:22]#[N:23].[Cl:1][N:2]1[C:3](=[O:4])[CH2:5][CH2:6][C:7]1=[O:8].[N+:9](=[O:10])([O-:11])[c:12]1[c:13]2[cH:14][cH:15][nH:16][c:17]2[cH:18][cH:19][cH:20]1>>[Cl:1][c:14]1[c:13]2[c:12]([N+:9](=[O:10])[O-:11])[cH:20][cH:19][cH:18][c:17]2[nH:16][cH:15]1Participants
5
Sources & evidence
- ORD record
- ord-59c2a9d9f7e8442dad0dad3a549800af
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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