Chloride → HCID 54301512, compound

HRID 1114728Notes

Reaction equation

HRID 1114728 reaction equation
[Br:29][c:30]1[c:31]2[c:35]([cH:36][cH:37][cH:38]1)[NH:34][C:33](=[O:39])[C:32]2=[CH:40][c:41]1[nH:42][cH:43][cH:44][c:45]1[O:46][CH3:47].[C:15]([Mg+:16])#[CH:17].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[Cl-:14].[Cu:48][I:49].[N+:18]([c:19]1[cH:20][c:21]([CH:25]=[O:26])[cH:22][cH:23][cH:24]1)([O-:27])=[O:28].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]([C:11]#[CH:12])[OH:13])[cH:7][cH:8][cH:9]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH:10]([C:11]#[C:12][c:30]2[c:31]3[c:35]([cH:36][cH:37][cH:38]2)[NH:34][C:33](=[O:39])[C:32]3=[CH:40][c:41]2[nH:42][cH:43][cH:44][c:45]2[O:46][CH3:47])[OH:13])[cH:7][cH:8][cH:9]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 6228DimethylformamideHCID 74493-NitrobenzaldehydeHCID 8471TriethylamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 2596551-(3-nitrophenyl)prop-2-yn-1-olHCID 542125274-bromo-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-1H-indol-2-oneHCID 178462448HCID 178462448, compound

Product 1

HCID 54301512HCID 54301512, compound

Sources & evidence

ORD record
ord-eb8f32ea28d0406a98a6a47e816470fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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