Toluene → HCID 66756812, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([c:9]1[c:10]([O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:11][c:12]([I:15])[cH:13][cH:14]1)[S:24]([NH:25][C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])(=[O:33])=[O:34])=[O:35].[CH3:55][Si:56]([CH2:57][CH2:58][OH:59])([CH3:60])[CH3:61].[CH3:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[O:62]=[C:63]([O:64][CH:65]([CH3:66])[CH3:67])[N:68]=[N:69][C:70]([O:71][CH:72]([CH3:73])[CH3:74])=[O:75].[c:36]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([c:9]1[c:10]([O:16][CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:11][c:12]([I:15])[cH:13][cH:14]1)[S:24]([N:25]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:58][CH2:57][Si:56]([CH3:55])([CH3:60])[CH3:61])(=[O:33])=[O:34])=[O:35]Participants
6
Sources & evidence
- ORD record
- ord-ca2da50b071d43938a35174d629fc025
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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