U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C11H11NO2
Molecular Weight 189.2105
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl phenylcyanoacetate

SMILES

CCOC(=O)C(C#N)C1=CC=CC=C1

InChI

InChIKey=SXIRJEDGTAKGKU-UHFFFAOYSA-N
InChI=1S/C11H11NO2/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Ethyl phenylcyanoacetate
Systematic Name English
NSC-362
Preferred Name English
Phenylcyanoacetic acid ethyl ester
Systematic Name English
Ethyl (±)-2-cyano-2-phenylacetate
Systematic Name English
Ethyl cyanophenylacetate
Systematic Name English
Ethyl ?-cyanophenylacetate
Systematic Name English
Ethyl ?-cyano-?-phenylacetate
Systematic Name English
Ethyl 2-cyano-2-phenylacetate
Systematic Name English
Benzeneacetic acid, ?-cyano-, ethyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
WJ2Z34X5XM
Created by admin on Wed Apr 02 19:10:35 GMT 2025 , Edited by admin on Wed Apr 02 19:10:35 GMT 2025
PRIMARY
PUBCHEM
95298
Created by admin on Wed Apr 02 19:10:35 GMT 2025 , Edited by admin on Wed Apr 02 19:10:35 GMT 2025
PRIMARY
NSC
362
Created by admin on Wed Apr 02 19:10:35 GMT 2025 , Edited by admin on Wed Apr 02 19:10:35 GMT 2025
PRIMARY
CAS
4553-07-5
Created by admin on Wed Apr 02 19:10:35 GMT 2025 , Edited by admin on Wed Apr 02 19:10:35 GMT 2025
PRIMARY