Salicylic Acid → HCID 67175546, compound
Reaction equation
[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:71][C:72]#[N:73].[N:1]1([C:7]([CH2:8][CH2:9][CH:10]=[CH:11][CH2:12][CH:13]=[CH:14][CH2:15][CH:16]=[CH:17][CH2:18][CH:19]=[CH:20][CH2:21][CH:22]=[CH:23][CH2:24][CH:25]=[CH:26][CH2:27][CH3:28])=[O:29])[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[OH:30][C:31](=[O:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][c:38]1[OH:39].[P-:47]([F:48])([F:49])([F:50])([F:51])([F:52])[F:53].[n:54]1([O:55][C:56]([N:57]([CH3:58])[CH3:59])=[N+:60]([CH3:61])[CH3:62])[c:63]2[n:64][cH:65][cH:66][cH:67][c:68]2[n:69][n:70]1>>[N:1]1([C:7]([CH2:8][CH2:9][CH:10]=[CH:11][CH2:12][CH:13]=[CH:14][CH2:15][CH:16]=[CH:17][CH2:18][CH:19]=[CH:20][CH2:21][CH:22]=[CH:23][CH2:24][CH:25]=[CH:26][CH2:27][CH3:28])=[O:29])[CH2:2][CH2:3][N:4]([C:31](=[O:30])[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[OH:39])[CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-d6a80713a2384b828a7bcc1960384908
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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