Potassium Cation → HCID 178462961, compound

HRID 312400Notes

Reaction equation

HRID 312400 reaction equation
[Br:27][CH2:28][CH2:29][CH:30]=[C:31]1[c:32]2[c:33]([cH:42][cH:43][c:44]([C:46]([CH3:47])([CH3:48])[OH:49])[cH:45]2)[O:34][CH2:35][c:36]2[c:37]1[cH:38][cH:39][cH:40][n:41]2.[C:51](#[N:52])[CH3:53].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:20]1)[N:7]([CH2:18][CH3:19])[C:8](=[O:17])[CH2:9][N:10]([CH:12]1[CH2:13][NH:14][CH2:15][CH2:16]1)[CH2:11]2.[K+:21].[K+:22].[O-:23][C:24]([O-:25])=[O:26].[OH2:50]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:20]1)[N:7]([CH2:18][CH3:19])[C:8](=[O:17])[CH2:9][N:10]([CH:12]1[CH2:13][N:14]([CH2:28][CH2:29][CH:30]=[C:31]3[c:32]4[c:33]([cH:42][cH:43][c:44]([C:46]([CH3:47])([CH3:48])[OH:49])[cH:45]4)[O:34][CH2:35][c:36]4[c:37]3[cH:38][cH:39][cH:40][n:41]4)[CH2:15][CH2:16]1)[CH2:11]2

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6342AcetonitrileHCID 19660Carbonate IonHCID 23136855HCID 23136855, compoundHCID 666859992-[5-(3-Bromo-propylidene)-5,1 1-dihydro-10-oxa-1-aza-dibenzo[a,d]cyclohepten-7-yl]-propan-2-ol

Product 1

HCID 178462961HCID 178462961, compound

Sources & evidence

ORD record
ord-6fa18718ba1f4e6b9d7c378f42243c5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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