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Details

Stereochemistry ACHIRAL
Molecular Formula C13H15N5O6
Molecular Weight 337.2881
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PIPERAZINECARBOXYLIC ACID, 4-(7-NITRO-4-BENZOFURAZANYL)-, ETHYL ESTER, N-OXIDE

SMILES

CCOC(=O)N1CCN(CC1)C2=CC=C(C3=NO[N+]([O-])=C23)[N+]([O-])=O

InChI

InChIKey=WEKPPFGPFSTMIB-UHFFFAOYSA-N
InChI=1S/C13H15N5O6/c1-2-23-13(19)16-7-5-15(6-8-16)10-4-3-9(17(20)21)11-12(10)18(22)24-14-11/h3-4H,2,5-8H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-PIPERAZINECARBOXYLIC ACID, 4-(7-NITRO-4-BENZOFURAZANYL)-, ETHYL ESTER, N-OXIDE
Systematic Name English
NSC-228100
Preferred Name English
ETHYL 4-(7-NITRO-3-OXIDO-2,1,3-BENZOXADIAZOL-3-IUM-4-YL)PIPERAZINE-1-CARBOXYLATE
Systematic Name English
ETHOXYCARBONYLPIPERAZINYL)-7-NITROBENZOFUROXAN, 4-(4-
Common Name English
Code System Code Type Description
NSC
228100
Created by admin on Mon Mar 31 18:35:02 GMT 2025 , Edited by admin on Mon Mar 31 18:35:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID90210777
Created by admin on Mon Mar 31 18:35:02 GMT 2025 , Edited by admin on Mon Mar 31 18:35:02 GMT 2025
PRIMARY
FDA UNII
CCQ9NSK7YR
Created by admin on Mon Mar 31 18:35:02 GMT 2025 , Edited by admin on Mon Mar 31 18:35:02 GMT 2025
PRIMARY
PUBCHEM
313578
Created by admin on Mon Mar 31 18:35:02 GMT 2025 , Edited by admin on Mon Mar 31 18:35:02 GMT 2025
PRIMARY
CAS
61785-56-6
Created by admin on Mon Mar 31 18:35:02 GMT 2025 , Edited by admin on Mon Mar 31 18:35:02 GMT 2025
PRIMARY
NIH
NCATS
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