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Details

Stereochemistry ACHIRAL
Molecular Formula C11H10N4O7
Molecular Weight 310.2197
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ethyl 2-(5-hydroxy-7-methoxy-2-nitropyrrolo[2,3-d]pyridazin-3-yl)-2-oxoacetate

SMILES

CCOC(=O)C(=O)C1=C(NC2=C1C=[N+]([O-])N=C2OC)[N+]([O-])=O

InChI

InChIKey=NDWPZMNLIOYJQK-UHFFFAOYSA-N
InChI=1S/C11H10N4O7/c1-3-22-11(17)8(16)6-5-4-14(18)13-10(21-2)7(5)12-9(6)15(19)20/h4,12H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C11H10N4O7
Molecular Weight 310.2197
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 Wed Apr 02 17:20:58 GMT 2025
Edited
by admin
on Wed Apr 02 17:20:58 GMT 2025
Record UNII
WX2BMJ5X2F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ethyl 2-(5-hydroxy-7-methoxy-2-nitropyrrolo[2,3-d]pyridazin-3-yl)-2-oxoacetate
Systematic Name English
NSC-193002
Preferred Name English
1H-Pyrrolo[2,3-d]pyridazine-3-acetic acid, 7-methoxy-2-nitro-?-oxo-, ethyl ester, 5-oxide
Systematic Name English
ETHYL (5-HYDROXY-2-(HYDROXY(OXIDO)AMINO)-7-METHOXY-1H-5LAMBDA(5)-PYRROLO(2,3-D)PYRIDAZIN-3-YL)(OXO)ACETATE
Common Name English
Code System Code Type Description
CAS
50450-99-2
Created by admin on Wed Apr 02 17:20:58 GMT 2025 , Edited by admin on Wed Apr 02 17:20:58 GMT 2025
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NSC
193002
Created by admin on Wed Apr 02 17:20:58 GMT 2025 , Edited by admin on Wed Apr 02 17:20:58 GMT 2025
PRIMARY
FDA UNII
WX2BMJ5X2F
Created by admin on Wed Apr 02 17:20:58 GMT 2025 , Edited by admin on Wed Apr 02 17:20:58 GMT 2025
PRIMARY
EPA CompTox
DTXSID20964690
Created by admin on Wed Apr 02 17:20:58 GMT 2025 , Edited by admin on Wed Apr 02 17:20:58 GMT 2025
PRIMARY
PUBCHEM
303651
Created by admin on Wed Apr 02 17:20:58 GMT 2025 , Edited by admin on Wed Apr 02 17:20:58 GMT 2025
PRIMARY