Sodium ion → 2-Methyl-5-{4-[2-(3-nitrophenyl)propyl]-1-piperazinyl}quinoline
Reaction equation
[C:40]([O:41][BH-:42]([O:43][C:44](=[O:45])[CH3:46])[O:47][C:48](=[O:49])[CH3:50])(=[O:51])[CH3:52].[CH3:14][c:15]1[n:16][c:17]2[cH:18][cH:19][cH:20][c:21]([N:25]3[CH2:26][CH2:27][N:28]([CH2:31][CH2:32][c:33]4[cH:34][c:35]([NH2:39])[cH:36][cH:37][cH:38]4)[CH2:29][CH2:30]3)[c:22]2[cH:23][cH:24]1.[Cl:54][CH2:55][Cl:56].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]([CH:11]=[O:12])[CH3:13])[cH:7][cH:8][cH:9]1.[Na+:53]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]([CH2:11][N:28]2[CH2:27][CH2:26][N:25]([c:21]3[cH:20][cH:19][cH:18][c:17]4[n:16][c:15]([CH3:14])[cH:24][cH:23][c:22]43)[CH2:30][CH2:29]2)[CH3:13])[cH:7][cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-c7632db89f6a4f3d866a6848b12cd2de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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