Hydrochloric Acid → 2-(3-chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)-N-methoxy-N-methylpropanamide

HRID 167138Notes

Reaction equation

HRID 167138 reaction equation
[CH3:2][O:3][NH:4][CH3:5].[CH3:44][N:45]([CH3:46])[CH2:47][CH2:48][CH2:49][N:50]=[C:51]=[N:52][CH2:53][CH3:54].[CH3:65][C:66]#[N:67].[CH3:68][CH2:69][O:70][C:71](=[O:72])[CH3:73].[CH3:74][CH2:75][N:76]([CH2:77][CH3:78])[CH2:79][CH3:80].[Cl:6][c:7]1[cH:8][c:9]([CH:17]([C:18](=[O:19])[OH:20])[CH2:21][CH:22]2[CH2:23][C:24]3([O:25][CH:26]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[CH:27]([c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[O:28]3)[CH2:41][CH2:42]2)[cH:10][cH:11][c:12]1[S:13](=[O:14])(=[O:15])[CH3:16].[ClH:1].[ClH:43].[OH:55][n:56]1[c:57]2[cH:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[CH3:2][O:3][N:4]([CH3:5])[C:18]([CH:17]([c:9]1[cH:8][c:7]([Cl:6])[c:12]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:10]1)[CH2:21][CH:22]1[CH2:23][C:24]2([O:25][CH:26]([c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[CH:27]([c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[O:28]2)[CH2:41][CH2:42]1)=[O:20]

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6342AcetonitrileHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 14232N,O-DimethylhydroxylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 722571642-(3-Chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)propanoic acid

Product 1

HCID 1785026992-(3-chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)-N-methoxy-N-methylpropanamide

Sources & evidence

ORD record
ord-d070f401170747619b3befc09f706a93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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