Water → HCID 67265611, compound

HRID 179071Notes

Reaction equation

HRID 179071 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH3:34][S:35]([O:36][CH2:39][C:40]([CH3:41])([N+:42](=[O:43])[O-:44])[CH3:45])(=[O:37])=[O:38].[Cl:7][c:8]1[c:9](-[c:14]2[cH:15][c:16]([NH:21][C:22]([c:23]3[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)=[O:33])[cH:17][cH:18][c:19]2[OH:20])[n:10]([CH3:13])[n:11][cH:12]1.[Cs+:5].[Cs+:6].[OH2:46]>>[Cl:7][c:8]1[c:9](-[c:14]2[cH:15][c:16]([NH:21][C:22]([c:23]3[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)=[O:33])[cH:17][cH:18][c:19]2[O:20][CH2:39][C:40]([CH3:41])([N+:42](=[O:43])[O-:44])[CH3:45])[n:10]([CH3:13])[n:11][cH:12]1

Participants

6

Reactant 5

HCID 962WaterHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 20452658HCID 20452658, compoundHCID 136387987HCID 136387987, compound

Product 1

HCID 67265611HCID 67265611, compound

Sources & evidence

ORD record
ord-1e0e3f7ff20f467592ed77172543dc8b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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