Acetate → HCID 178493137, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[C:35](=[O:36])([O-:37])[O-:38].[CH3:11][C:12](=[O:13])[O-:14].[CH3:15][O:16][c:17]1[cH:18][c:19]([CH2:23][CH2:24][c:25]2[n:26][c:27]3[c:28]([n:29][cH:30][c:31]([I:33])[cH:32]3)[nH:34]2)[n:20][cH:21][cH:22]1.[Cl-:42].[K+:10].[K+:39].[K+:40].[Li+:41].[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[OH2:49].[Pd:50].[c:108]1([P:109]([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)[cH:122][cH:123][cH:124][cH:125][cH:126]1.[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1.[c:70]1([P:71]([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)[cH:84][cH:85][cH:86][cH:87][cH:88]1.[c:89]1([P:90]([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)[cH:103][cH:104][cH:105][cH:106][cH:107]1>>[c:2]1(-[c:31]2[cH:30][n:29][c:28]3[c:27]([n:26][c:25]([CH2:24][CH2:23][c:19]4[cH:18][c:17]([O:16][CH3:15])[cH:22][cH:21][n:20]4)[nH:34]3)[cH:32]2)[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1Participants
12
Reactant 11
Product 1
Sources & evidence
- ORD record
- ord-5e8625525aca4c8f9c5350f3843f600a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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