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Potassium Cation → Ethyl 3-[4-[3-(3,4-dichlorophenyl)prop-2-enoyl]-7-oxo-1,4-diazepan-1-yl]propanoate

HRID 1145267
Notes
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Reaction equation

HRID 1145267 reaction equation
[Br:21][CH2:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28].[Cl:1][c:2]1[cH:3][c:4]([CH:9]=[CH:10][C:11](=[O:12])[N:13]2[CH2:14][CH2:15][NH:16][C:17](=[O:20])[CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8].[H-:30].[K+:36].[Na+:29].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[S:31](=[O:32])(=[O:33])([OH:34])[O-:35]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]=[CH:10][C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([CH2:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])[C:17](=[O:20])[CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 813Potassium CationHCID 923Sodium IonHCID 6228DimethylformamideHCID 61778Sulfate, hydrogenHCID 68320Ethyl 3-bromopropionateHCID 166653HydrideHCID 670748421-[3-(3,4-Dichlorophenyl)prop-2-enoyl]-1,4-diazepan-5-one

Product 1

HCID 67074855Ethyl 3-[4-[3-(3,4-dichlorophenyl)prop-2-enoyl]-7-oxo-1,4-diazepan-1-yl]propanoate

Sources & evidence

ORD record
ord-76d6b068df694bf293da6fd4075c5344
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes