Water → 1-(2-Cyano-4-nitrophenyl)-4-piperidinyl benzoate

HRID 1544041Notes

Reaction equation

HRID 1544041 reaction equation
[C:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)(=[O:33])[Cl:34].[CH3:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:12]2[CH2:13][CH2:14][CH:15]([OH:18])[CH2:16][CH2:17]2)[c:8]([C:9]#[N:10])[cH:11]1.[OH2:35].[cH:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:12]2[CH2:13][CH2:14][CH:15]([O:18][C:26]([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)=[O:33])[CH2:16][CH2:17]2)[c:8]([C:9]#[N:10])[cH:11]1

Participants

6

Reactant 5

HCID 962WaterHCID 1049PyridineHCID 1140TolueneHCID 7412Benzoyl chlorideHCID 172213732-(4-Hydroxypiperidin-1-yl)-5-nitrobenzonitrile

Product 1

HCID 222280761-(2-Cyano-4-nitrophenyl)-4-piperidinyl benzoate

Sources & evidence

ORD record
ord-ab01803f84a841f0ad99cfd4cbd93d0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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