Water → HCID 178457629, compound

HRID 171193Notes

Reaction equation

[C:69](=[O:70])([O-:71])[O-:72].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH2:9][CH2:10][N:11]1[C:12](=[O:51])[C:13]([CH2:44][O:45][S:46]([CH3:47])(=[O:48])=[O:49])([CH3:50])[O:14][c:15]2[c:16]1[cH:17][c:18]([C:25](=[O:26])[N:27]([CH:28]1[CH2:29][N:30]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:31][CH2:32][CH2:33]1)[CH:41]([CH3:42])[CH3:43])[c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)[C:52](=[O:53])[O:54][CH2:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[CH3:76][N:77]([CH3:78])[CH:79]=[O:80].[Cs+:73].[Cs+:74].[OH2:75].[OH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH2:9][CH2:10][N:11]1[C:12](=[O:51])[C:13]([CH2:44][O:45][c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([CH3:50])[O:14][c:15]2[c:16]1[cH:17][c:18]([C:25](=[O:26])[N:27]([CH:28]1[CH2:29][N:30]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:31][CH2:32][CH2:33]1)[CH:41]([CH3:42])[CH3:43])[c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)[C:52](=[O:53])[O:54][CH2:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1

Participants

Reactant 6

HCID 962Water

HCID 996Phenol

HCID 6228Dimethylformamide

HCID 19660Carbonate Ion

HCID 104967Cesium cation2×

HCID 178457631HCID 178457631, compound

Product 1

HCID 178457629HCID 178457629, compound

Sources & evidence

ORD record: ord-9cde1c19baf9418da78711d593add017
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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