Potassium Cation → 4-(4-methylphenyl)-1-(3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-1-propyl)-4-piperidinecarboxylic acid ethyl ester

HRID 96996Notes

Reaction equation

HRID 96996 reaction equation
[Br:19][CH2:20][CH2:21][CH:22]=[C:23]1[c:24]2[c:25]([cH:34][cH:35][cH:36][cH:37]2)[CH2:26][CH2:27][c:28]2[c:29]1[cH:30][cH:31][cH:32][cH:33]2.[C:38](=[O:39])([O-:40])[O-:41].[CH3:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:14](=[O:15])[O:16][CH2:17][CH3:18])[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:6][cH:7]1.[CH3:46][C:47](=[O:48])[CH2:49][CH3:50].[I-:45].[K+:42].[K+:43].[K+:44].[OH2:51]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:14](=[O:15])[O:16][CH2:17][CH3:18])[CH2:9][CH2:10][N:11]([CH2:20][CH2:21][CH:22]=[C:23]3[c:24]4[c:25]([cH:34][cH:35][cH:36][cH:37]4)[CH2:26][CH2:27][c:28]4[c:29]3[cH:30][cH:31][cH:32][cH:33]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 962WaterHCID 6569Methyl Ethyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 17126855-(3-bromopropylidene)-10,11-dihydro-5H-dibenzo[a,d]cyclohepteneHCID 19261381Ethyl 4-(4-methylphenyl)piperidine-4-carboxylate

Product 1

HCID 538364604-(4-methylphenyl)-1-(3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-1-propyl)-4-piperidinecarboxylic acid ethyl ester

Sources & evidence

ORD record
ord-2aa142edb3a5466c8b6601f941e3b4f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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