Potassium Cation → HCID 13105606, compound

HRID 149171Notes

Reaction equation

HRID 149171 reaction equation
[CH3:46][CH:47]([CH3:48])[CH2:49][C:50](=[O:51])[CH3:52].[Cl:1][CH2:2][CH2:3][NH:4][c:5]1[c:6]([N+:15](=[O:16])[O-:17])[cH:7][c:8]([C:11]([F:12])([F:13])[F:14])[cH:9][cH:10]1.[I-:44].[K+:43].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[OH2:45].[c:18]1([CH:24]([N:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[CH2:2]([CH2:3][NH:4][c:5]1[c:6]([N+:15](=[O:16])[O-:17])[cH:7][c:8]([C:11]([F:12])([F:13])[F:14])[cH:9][cH:10]1)[N:28]1[CH2:27][CH2:26][N:25]([CH:24]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[CH2:30][CH2:29]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 923Sodium ion2×HCID 962WaterHCID 7909Methyl Isobutyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 70048BenzhydrylpiperazineHCID 20506262HCID 20506262, compound

Product 1

HCID 13105606HCID 13105606, compound

Sources & evidence

ORD record
ord-41463ce2dae543c4b90c2b60023f9c83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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