Potassium Cation → 2-(4-Fluorophenyl)-1-(4-[2-(1-methyl(2-piperidyl))ethoxy]benzyl)-6-(phenylmethoxy)-1,2,3,4-tetrahydroisoquinoline

HRID 2327187Notes

Reaction equation

HRID 2327187 reaction equation
[C:34](=[O:35])([O-:36])[O-:37].[CH3:53][OH:54].[Cl:40][CH2:41][CH2:42][CH:43]1[N:44]([CH3:49])[CH2:45][CH2:46][CH2:47][CH2:48]1.[Cl:50][CH2:51][Cl:52].[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH:9]([CH2:26][c:27]3[cH:28][cH:29][c:30]([OH:33])[cH:31][cH:32]3)[c:10]3[cH:11][cH:12][c:13]([O:18][CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[cH:14][c:15]3[CH2:16][CH2:17]2)[cH:6][cH:7]1.[K+:38].[K+:39].[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH2:60]>>[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH:9]([CH2:26][c:27]3[cH:28][cH:29][c:30]([O:33][CH2:41][CH2:42][CH:43]4[N:44]([CH3:49])[CH2:45][CH2:46][CH2:47][CH2:48]4)[cH:31][cH:32]3)[c:10]3[cH:11][cH:12][c:13]([O:18][CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[cH:14][c:15]3[CH2:16][CH2:17]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 887MethanolHCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 30165662-(2-Chloroethyl)-1-methylpiperidineHCID 234407672-(4-Fluorophenyl)-1-(4-hydroxybenzyl)-6-(phenylmethoxy)-1,2,3,4-tetrahydroisoquinoline

Product 1

HCID 693163412-(4-Fluorophenyl)-1-(4-[2-(1-methyl(2-piperidyl))ethoxy]benzyl)-6-(phenylmethoxy)-1,2,3,4-tetrahydroisoquinoline

Sources & evidence

ORD record
ord-877a28bc0a3243c79f559427c2294a84
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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