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Details

Stereochemistry RACEMIC
Molecular Formula C11H19NO4
Molecular Weight 229.2729
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 2-cyano-4,4-diethoxybutyrate

SMILES

CCOC(CC(C#N)C(=O)OCC)OCC

InChI

InChIKey=AHKACZDKUNMFBD-UHFFFAOYSA-N
InChI=1S/C11H19NO4/c1-4-14-10(15-5-2)7-9(8-12)11(13)16-6-3/h9-10H,4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Ethyl 2-cyano-4,4-diethoxybutyrate
Systematic Name English
2-Cyano-4,4-diethoxybutyric acid ethyl ester
Preferred Name English
Succinaldehydic acid, 2-cyano-, ethyl ester, diethyl acetal
Systematic Name English
Butanoic acid, 2-cyano-4,4-diethoxy-, ethyl ester
Systematic Name English
Ethyl 2-cyano-4,4-diethoxybutanoate
Systematic Name English
Code System Code Type Description
CAS
52133-67-2
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
FDA UNII
3PH566ZFZ3
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID90399970
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
PUBCHEM
4151505
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
NIH
NCATS
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