Sodium ion → 3-Benzoyl-10-(2-fluorophenyl)-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
Reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[N:9]1[CH2:10][CH2:11][c:12]2[nH:13][c:14]3[cH:15][cH:16][cH:17][c:18]([Br:23])[c:19]3[c:20]2[CH2:21][CH2:22]1.[CH2:47]([CH2:48][O:49][CH3:50])[O:51][CH3:52].[CH3:34][CH2:35][O:36][C:37]([CH3:38])=[O:39].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46].[F:24][c:25]1[c:26]([B:31]([OH:32])[OH:33])[cH:27][cH:28][cH:29][cH:30]1.[Na+:53].[Na+:54].[O-:55][C:56](=[O:57])[O-:58].[cH:59]1[cH:60][cH:61][c:62]([P:63]([Pd:64]([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[P:103]([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)([c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)([c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[c:128]2[cH:129][cH:130][cH:131][cH:132][cH:133]2)[cH:134][cH:135]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[N:9]1[CH2:10][CH2:11][c:12]2[nH:13][c:14]3[cH:15][cH:16][cH:17][c:18](-[c:26]4[c:25]([F:24])[cH:30][cH:29][cH:28][cH:27]4)[c:19]3[c:20]2[CH2:21][CH2:22]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-1ee50487314a43da85cebfcf0581d5c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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