Potassium Cation → 2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]methyl-1,4-benzodioxan

HRID 683488Notes

Reaction equation

HRID 683488 reaction equation
[CH3:23][S:24]([O:25][CH2:28][CH:29]1[CH2:30][O:31][c:32]2[c:33]([cH:35][cH:36][cH:37][cH:38]2)[O:34]1)(=[O:26])=[O:27].[CH3:39][C:40]#[N:41].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1.[K+:17].[K+:18].[O-:19][C:20]([O-:21])=[O:22]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][N:12]([CH2:28][CH:29]4[CH2:30][O:31][c:32]5[c:33]([cH:35][cH:36][cH:37][cH:38]5)[O:34]4)[CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 2634452,3-Dihydro-1,4-benzodioxin-2-ylmethyl methanesulfonateHCID 8494213-(4-Piperidyl)-6-fluoro-1,2-benzisoxazole

Product 1

HCID 153849682-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]methyl-1,4-benzodioxan

Sources & evidence

ORD record
ord-d670dbc914304912894d1c7429b2efea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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