Toluene → Methyl 3-(3-cyanophenyl)-5-(4-nitrophenyl)-2,4-pentadienoate

HRID 215661Notes

Reaction equation

HRID 215661 reaction equation
[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][C:12](=[O:13])[c:14]2[cH:15][c:16]([C:17]#[N:18])[cH:19][cH:20][cH:21]2)[cH:8][cH:9]1.[c:22]1([P:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)=[CH:41][C:42](=[O:43])[O:44][CH3:45])[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]=[CH:11][C:12]([c:14]2[cH:15][c:16]([C:17]#[N:18])[cH:19][cH:20][cH:21]2)=[CH:41][C:42](=[O:43])[O:44][CH3:45])[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 17453Acetic acid, 2-(triphenylphosphoranylidene)-, methyl esterHCID 542130173-[3-(4-Nitrophenyl)-1-oxo-2-propenyl]benzonitrile

Product 1

HCID 54059907Methyl 3-(3-cyanophenyl)-5-(4-nitrophenyl)-2,4-pentadienoate

Sources & evidence

ORD record
ord-f8cb402cc659497fbbd5f8892d3f0651
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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