Bicarbonate Ion → Methyl 3-[4-(4-nitrophenyl)piperazinyl]propanoate

HRID 169539

Reaction equation

HRID 169539 reaction equation
[CH3:16][O:17][C:18]([CH2:19][CH2:20][Br:21])=[O:22].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[cH:8][cH:9]1.[Na+:28].[O-:24][C:25]([OH:26])=[O:27].[O:29]=[CH:30][N:31]([CH3:32])[CH3:33].[OH2:23]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][N:13]([CH2:20][CH2:19][C:18]([O:17][CH3:16])=[O:22])[CH2:14][CH2:15]2)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 76934Methyl 3-bromopropanoateHCID 804471-(4-Nitrophenyl)piperazine

Product 1

HCID 16450139Methyl 3-[4-(4-nitrophenyl)piperazinyl]propanoate

Sources & evidence

ORD record
ord-f07b6e800ea24b8c9256e50c4ccf6107
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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