Sodium ion → HCID 70304708, compound

HRID 134354

Reaction equation

HRID 134354 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][C:17](=[O:18])[N:19]3[CH2:20][CH2:21][N:22]([CH2:25][c:26]4[cH:27][c:28]5[c:32]([cH:33][cH:34]4)[O:31][CH2:30][O:29]5)[CH2:23][CH2:24]3)[cH:13][cH:14]2)[n:6][cH:7]1.[CH3:49][C:50]([CH3:51])([O-:52])[CH3:53].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cl:35][c:36]1[cH:37][c:38]([N:43]2[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]2)[cH:39][cH:40][c:41]1[Cl:42].[Na+:54].[O:101]=[C:102]([CH:103]=[CH:104][c:105]1[cH:106][cH:107][cH:108][cH:109][cH:110]1)[CH:111]=[CH:112][c:113]1[cH:114][cH:115][cH:116][cH:117][cH:118]1.[O:65]=[C:66]([CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1)[CH:75]=[CH:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[O:83]=[C:84]([CH:85]=[CH:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1)[CH:93]=[CH:94][c:95]1[cH:96][cH:97][cH:98][cH:99][cH:100]1.[OH2:55].[Pd:63].[Pd:64]>>[c:2]1([N:46]2[CH2:45][CH2:44][N:43]([c:38]3[cH:37][c:36]([Cl:35])[c:41]([Cl:42])[cH:40][cH:39]3)[CH2:48][CH2:47]2)[cH:3][cH:4][c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][C:17](=[O:18])[N:19]3[CH2:20][CH2:21][N:22]([CH2:25][c:26]4[cH:27][c:28]5[c:32]([cH:33][cH:34]4)[O:31][CH2:30][O:29]5)[CH2:23][CH2:24]3)[cH:13][cH:14]2)[n:6][cH:7]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 23938Palladium2×HCID 936011-(3,4-Dichlorophenyl)piperazineHCID 95417Dibenzylidene acetone3×HCID 45749132-Methylpropan-2-olateHCID 68524325HCID 68524325, compound

Product 1

HCID 70304708HCID 70304708, compound

Sources & evidence

ORD record
ord-0eddca3b3ada48eabc8b267db9b52049
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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