Sodium ion → 4-(4-Chloro-phenyl)-3-methyl-piperazine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:9]([CH3:10])([CH3:11])([CH3:12])[O:13][C:14](=[O:15])[N:16]1[CH2:17][CH:18]([CH3:22])[NH:19][CH2:20][CH2:21]1.[CH3:69][C:70]([CH3:71])([O-:72])[CH3:73].[CH3:75][c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1.[CH:102](=[CH:103][C:104]([CH:105]=[CH:106][c:107]1[cH:108][cH:109][cH:110][cH:111][cH:112]1)=[O:113])[c:114]1[cH:115][cH:116][cH:117][cH:118][cH:119]1.[CH:120](=[CH:121][C:122]([CH:123]=[CH:124][c:125]1[cH:126][cH:127][cH:128][cH:129][cH:130]1)=[O:131])[c:132]1[cH:133][cH:134][cH:135][cH:136][cH:137]1.[CH:84](=[CH:85][C:86]([CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1)=[O:95])[c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([Br:8])[cH:6][cH:7]1.[Na+:74].[Pd:82].[Pd:83].[cH:23]1[cH:24][cH:25][c:26]([P:27]([c:28]2[cH:29][cH:30][c:31]3[c:32]([cH:33][cH:34][cH:35][cH:36]3)[c:37]2-[c:38]2[c:39]3[c:40]([cH:41][cH:42][cH:43][cH:44]3)[cH:45][cH:46][c:47]2[P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:19]2[CH:18]([CH3:22])[CH2:17][N:16]([C:14]([O:13][C:9]([CH3:10])([CH3:11])[CH3:12])=[O:15])[CH2:21][CH2:20]2)[cH:6][cH:7]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-b30956373e2b40b7972d30af730b549b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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