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Details

Stereochemistry RACEMIC
Molecular Formula C12H13N3O5
Molecular Weight 279.2487
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl ?-cyano-6-methoxy-3-nitro-2-pyridinepropanoate

SMILES

CCOC(=O)CC(C#N)C1=NC(OC)=CC=C1[N+]([O-])=O

InChI

InChIKey=YWPYBMGCRDOPCT-UHFFFAOYSA-N
InChI=1S/C12H13N3O5/c1-3-20-11(16)6-8(7-13)12-9(15(17)18)4-5-10(14-12)19-2/h4-5,8H,3,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H13N3O5
Molecular Weight 279.2487
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 05:44:57 GMT 2025
Edited
by admin
on Wed Apr 02 05:44:57 GMT 2025
Record UNII
4PE4K2W6CB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Pyridinepropanoic acid, ?-cyano-6-methoxy-3-nitro-, ethyl ester
Preferred Name English
Ethyl ?-cyano-6-methoxy-3-nitro-2-pyridinepropanoate
Systematic Name English
Code System Code Type Description
PUBCHEM
121002219
Created by admin on Wed Apr 02 05:44:57 GMT 2025 , Edited by admin on Wed Apr 02 05:44:57 GMT 2025
PRIMARY
FDA UNII
4PE4K2W6CB
Created by admin on Wed Apr 02 05:44:57 GMT 2025 , Edited by admin on Wed Apr 02 05:44:57 GMT 2025
PRIMARY