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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H11NO5
Molecular Weight 237.2087
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 3-(o-nitrophenyl)pyruvate

SMILES

CCOC(=O)C(=O)CC1=CC=CC=C1[N+]([O-])=O

InChI

InChIKey=AKWXORMMOJRIBI-UHFFFAOYSA-N
InChI=1S/C11H11NO5/c1-2-17-11(14)10(13)7-8-5-3-4-6-9(8)12(15)16/h3-6H,2,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H11NO5
Molecular Weight 237.2087
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:20:14 GMT 2025
Edited
by admin
on Tue Apr 01 19:20:14 GMT 2025
Record UNII
7X2UW99BD2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-157844
Preferred Name English
Ethyl 3-(o-nitrophenyl)pyruvate
Systematic Name English
Ethyl 3-(2-nitrophenyl)-2-oxopropanoate
Systematic Name English
Ethyl 2-nitro-?-oxobenzenepropanoate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70229064
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY
FDA UNII
7X2UW99BD2
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY
CAS
784-98-5
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY
PUBCHEM
69915
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY
ECHA (EC/EINECS)
212-318-9
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY
NSC
157844
Created by admin on Tue Apr 01 19:20:14 GMT 2025 , Edited by admin on Tue Apr 01 19:20:14 GMT 2025
PRIMARY