Acetonitrile → HCID 58707302, compound
Reaction equation
[CH3:42][C:43]#[N:44].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][c:7]2[c:8]([N+:14](=[O:15])[O-:16])[cH:9][cH:10][c:11]([F:13])[cH:12]2)[cH:17][cH:18][cH:19]1.[N:20]1([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]1>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][c:7]2[c:8]([N+:14](=[O:15])[O-:16])[cH:9][cH:10][c:11]([N:23]3[CH2:22][CH2:21][N:20]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:25][CH2:24]3)[cH:12]2)[cH:17][cH:18][cH:19]1Participants
5
Sources & evidence
- ORD record
- ord-4eabedf537b54ca69306b66fbceb717f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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