Potassium Cation → 1-{3-[7-(1-Hydroxy-1-methyl-ethyl)-11H-10-oxa-1-aza-dibenzo[a,d]cyclohepten-5-ylidene]-propyl}-4-phenyl-piperidin-4-ol

HRID 110907Notes

Reaction equation

HRID 110907 reaction equation
[Br:24][CH2:25][CH2:26][CH:27]=[C:28]1[c:29]2[c:30]([cH:39][cH:40][c:41]([C:43]([CH3:44])([CH3:45])[OH:46])[cH:42]2)[O:31][CH2:32][c:33]2[c:34]1[cH:35][cH:36][cH:37][n:38]2.[CH:47]([OH:48])([CH3:49])[CH3:50].[I-:23].[K+:22].[c:1]1([C:7]2([OH:13])[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[n:14]1[c:15]([CH3:16])[cH:17][cH:18][cH:19][c:20]1[CH3:21]>>[c:1]1([C:7]2([OH:13])[CH2:8][CH2:9][N:10]([CH2:25][CH2:26][CH:27]=[C:28]3[c:29]4[c:30]([cH:39][cH:40][c:41]([C:43]([CH3:44])([CH3:45])[OH:46])[cH:42]4)[O:31][CH2:32][c:33]4[c:34]3[cH:35][cH:36][cH:37][n:38]4)[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 813Potassium CationHCID 3776IsopropanolHCID 79372,6-LutidineHCID 30165Iodide IonHCID 963874-Phenylpiperidin-4-olHCID 666859992-[5-(3-Bromo-propylidene)-5,1 1-dihydro-10-oxa-1-aza-dibenzo[a,d]cyclohepten-7-yl]-propan-2-ol

Product 1

HCID 667583481-{3-[7-(1-Hydroxy-1-methyl-ethyl)-11H-10-oxa-1-aza-dibenzo[a,d]cyclohepten-5-ylidene]-propyl}-4-phenyl-piperidin-4-ol

Sources & evidence

ORD record
ord-ede8ba5bb0eb4614a9a5d521ec4f1738
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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