Ammonium → 1-(4-Amino-2-cyanophenyl)-4-piperidinyl benzoate

HRID 317208Notes

Reaction equation

HRID 317208 reaction equation
[C:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)(=[O:11])[O:12][CH:13]1[CH2:14][CH2:15][N:16]([c:19]2[c:20]([C:28]#[N:29])[cH:21][c:22]([N+:25]([O-:26])=[O:27])[cH:23][cH:24]2)[CH2:17][CH2:18]1.[CH3:31][CH2:32][OH:33].[Cl-:1].[Fe:30].[NH4+:2].[OH2:3]>>[C:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)(=[O:11])[O:12][CH:13]1[CH2:14][CH2:15][N:16]([c:19]2[c:20]([C:28]#[N:29])[cH:21][c:22]([NH2:25])[cH:23][cH:24]2)[CH2:17][CH2:18]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 962WaterHCID 23925IronHCID 222280761-(2-Cyano-4-nitrophenyl)-4-piperidinyl benzoate

Product 1

HCID 222279351-(4-Amino-2-cyanophenyl)-4-piperidinyl benzoate

Sources & evidence

ORD record
ord-f1f2f5373e5e47be92a16cc8b0772cee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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