Sodium ion → HCID 68578129, compound

HRID 1546901Notes

Reaction equation

HRID 1546901 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:18][cH:19]1)[CH2:6][N:7]([C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[CH2:8][CH2:9][O:10]2.[CH2:20]([CH3:21])[NH:22][CH3:23].[CH3:24][C:25]([CH3:26])([O-:27])[CH3:28].[Na+:29].[O:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1.[O:39]=[C:40]([CH:41]=[CH:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[CH:49]=[CH:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[O:57]=[C:58]([CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[O:75]=[C:76]([CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1)[CH:85]=[CH:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[OH2:30].[Pd:37].[Pd:38]>>[c:2]1([N:22]([CH2:20][CH3:21])[CH3:23])[cH:3][c:4]2[c:5]([cH:18][cH:19]1)[CH2:6][N:7]([C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[CH2:8][CH2:9][O:10]2

Participants

9

Reactant 8

HCID 923Sodium ionHCID 962WaterHCID 12219N-MethylethylamineHCID 23938Palladium2×HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3×HCID 45749132-Methylpropan-2-olateHCID 68578192HCID 68578192, compound

Product 1

HCID 68578129HCID 68578129, compound

Sources & evidence

ORD record
ord-dcbb4d0a2d1449bdb0627b1fbad6ac99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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