Sodium Ion → 3-Amino-4-[methyl-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)amino]benzonitrile
Reaction equation
[CH3:1][N:2]([c:3]1[c:4]([N+:11]([O-:12])=[O:13])[cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1)[c:14]1[cH:15][c:16]2[c:21]([cH:22][cH:23]1)[C:20]([CH3:24])([CH3:25])[CH2:19][CH2:18][C:17]2([CH3:26])[CH3:27].[CH3:31][CH2:32][O:33][C:34]([CH3:35])=[O:36].[Na+:29].[OH-:28].[OH2:30]>>[CH3:1][N:2]([c:3]1[c:4]([NH2:11])[cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1)[c:14]1[cH:15][c:16]2[c:21]([cH:22][cH:23]1)[C:20]([CH3:24])([CH3:25])[CH2:19][CH2:18][C:17]2([CH3:26])[CH3:27]Participants
6
Sources & evidence
- ORD record
- ord-9ac442773f644d3db3ddb4ba6dce96fb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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