Acetate → Ethyl 2-(1-benzylpiperidin-4-ylidene)-2-cyanoacetate

HRID 2346752Notes

Reaction equation

HRID 2346752 reaction equation
[C:15](#[N:16])[CH2:17][C:18](=[O:19])[O:20][CH2:21][CH3:22].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1.[CH3:23][C:24](=[O:25])[OH:26].[CH3:28][C:29](=[O:30])[O-:31].[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[Cl:39][CH2:40][Cl:41].[NH4+:27].[OH2:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11](=[C:17]([C:15]#[N:16])[C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH2:12][CH2:13]1

Participants

9

Reactant 8

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 962WaterHCID 1140TolueneHCID 6344DichloromethaneHCID 7764Ethyl cyanoacetateHCID 192201-Benzyl-4-piperidone

Product 1

HCID 424752Ethyl 2-(1-benzylpiperidin-4-ylidene)-2-cyanoacetate

Sources & evidence

ORD record
ord-9ec11a9a3c1f46db828c56bd9cf82b76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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