Acetone → Ethyl 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]piperidine-3-carboxylate

HRID 97952

Reaction equation

HRID 97952 reaction equation
[C:50](=[O:51])([O-:52])[O-:53].[CH2:23]([Li:24])[CH2:25][CH2:26][CH3:27].[CH3:1][c:2]1[c:3]([C:8](=[CH:9][CH2:10][O:11][CH2:12][CH2:13][CH2:14][OH:15])[c:16]2[c:17]([CH3:22])[cH:18][cH:19][cH:20][cH:21]2)[cH:4][cH:5][cH:6][cH:7]1.[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[CH3:65][C:66](=[O:67])[CH3:68].[I-:57].[K+:54].[K+:55].[K+:56].[NH:39]1[CH2:40][CH:41]([C:45](=[O:46])[O:47][CH2:48][CH3:49])[CH2:42][CH2:43][CH2:44]1.[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([Cl:34])(=[O:35])=[O:36])[cH:37][cH:38]1>>[CH3:1][c:2]1[c:3]([C:8](=[CH:9][CH2:10][O:11][CH2:12][CH2:13][CH2:14][N:39]2[CH2:40][CH:41]([C:45](=[O:46])[O:47][CH2:48][CH3:49])[CH2:42][CH2:43][CH2:44]2)[c:16]2[c:17]([CH3:22])[cH:18][cH:19][cH:20][cH:21]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

10

Reactant 9

HCID 180AcetoneHCID 813Potassium Cation3×HCID 1140TolueneHCID 73974-Toluenesulfonyl chlorideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 98969Ethyl nipecotateHCID 107563633-(3,3-Bis(2-methylphenyl)-2-propen-1-yloxy)-1-propanolHCID 178418339Butyllithium

Product 1

HCID 10789019Ethyl 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]piperidine-3-carboxylate

Sources & evidence

ORD record
ord-25563c818b6b45088d96d6220d5ffd37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…