Sodium ion → HCID 66596977, compound

HRID 663557Notes

Reaction equation

HRID 663557 reaction equation
[CH3:69][C:70]([CH3:71])([O-:72])[CH3:73].[CH3:75][NH:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[CH3:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][N:9]2[C:10](=[O:26])[CH2:11][CH2:12][c:13]3[c:14]([CH:21]4[O:22][CH2:23][CH2:24][O:25]4)[cH:15][cH:16][c:17]([O:19][CH3:20])[c:18]32)[cH:6][n:7]1.[Na+:74].[O:110]=[C:111]([CH:112]=[CH:113][c:114]1[cH:115][cH:116][cH:117][cH:118][cH:119]1)[CH:120]=[CH:121][c:122]1[cH:123][cH:124][cH:125][cH:126][cH:127]1.[O:128]=[C:129]([CH:130]=[CH:131][c:132]1[cH:133][cH:134][cH:135][cH:136][cH:137]1)[CH:138]=[CH:139][c:140]1[cH:141][cH:142][cH:143][cH:144][cH:145]1.[O:92]=[C:93]([CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1)[CH:102]=[CH:103][c:104]1[cH:105][cH:106][cH:107][cH:108][cH:109]1.[Pd:90].[Pd:91].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[c:36]3[c:60]([cH:61][cH:62][cH:63]2)[C:57]([CH3:58])([CH3:59])[c:39]2[c:38]([c:43]([P:44]([c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[c:51]4[cH:52][cH:53][cH:54][cH:55][cH:56]4)[cH:42][cH:41][cH:40]2)[O:37]3)[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[c:2]1([N:76]([CH3:75])[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[cH:3][cH:4][c:5]([CH2:8][N:9]2[C:10](=[O:26])[CH2:11][CH2:12][c:13]3[c:14]([CH:21]4[O:22][CH2:23][CH2:24][O:25]4)[cH:15][cH:16][c:17]([O:19][CH3:20])[c:18]32)[cH:6][n:7]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 1140TolueneHCID 7515N-MethylanilineHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 45749132-Methylpropan-2-olateHCID 866139171-(6-Chloropyridin-3-ylmethyl)-5-[1,3]dioxolan-2-yl-8-methoxy-3,4-dihydro-1H-quinolin-2-one

Product 1

HCID 66596977HCID 66596977, compound

Sources & evidence

ORD record
ord-88a5e5e6a58e44968a049a3fd0df1877
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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