3-Nitroaniline → N-[[3-[4-[4-cyano-4-(3-nitroanilino)piperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

HRID 96453Notes

Reaction equation

HRID 96453 reaction equation
[N+:29](=[O:30])([O-:31])[c:32]1[cH:33][c:34]([NH2:35])[cH:36][cH:37][cH:38]1.[Na:26][C:27]#[N:28].[O:1]=[C:2]1[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:25])[cH:10][c:11]([N:14]3[C:15](=[O:24])[O:16][CH:17]([CH2:19][NH:20][C:21]([CH3:22])=[O:23])[CH2:18]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1>>[C:2]1([C:27]#[N:28])([NH:35][c:34]2[cH:33][c:32]([N+:29](=[O:30])[O-:31])[cH:38][cH:37][cH:36]2)[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:25])[cH:10][c:11]([N:14]3[C:15](=[O:24])[O:16][CH:17]([CH2:19][NH:20][C:21]([CH3:22])=[O:23])[CH2:18]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1

Participants

4

Reactant 3

HCID 74233-NitroanilineHCID 19599390N-[[3-[3-fluoro-4-(4-oxopiperidin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamideHCID 178511850HCID 178511850, compound

Product 1

HCID 68696243N-[[3-[4-[4-cyano-4-(3-nitroanilino)piperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Sources & evidence

ORD record
ord-40ed5b4269fc4c72bcea451c86e4d54c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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