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Details

Stereochemistry ACHIRAL
Molecular Formula C6H4ClNO4
Molecular Weight 189.553
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NIFURMERONE

SMILES

[O-][N+](=O)C1=CC=C(O1)C(=O)CCl

InChI

InChIKey=DQJAAEADFORVGZ-UHFFFAOYSA-N
InChI=1S/C6H4ClNO4/c7-3-4(9)5-1-2-6(12-5)8(10)11/h1-2H,3H2

HIDE SMILES / InChI

Molecular Formula C6H4ClNO4
Molecular Weight 189.553
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:11:44 GMT 2023
Edited
by admin
on Fri Dec 15 15:11:44 GMT 2023
Record UNII
F57Y390K2N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NIFURMERONE
INN   USAN  
USAN   INN  
Official Name English
NSC-84429
Code English
nifurmerone [INN]
Common Name English
NIFURMERONE [USAN]
Common Name English
5-NITRO-2-FURYL KETONE
Systematic Name English
ETHANONE, 2-CHLORO-1-(5-NITRO-2-FURANYL)-
Systematic Name English
NF-71
Code English
Classification Tree Code System Code
NCI_THESAURUS C514
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
Code System Code Type Description
INN
2082
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID90204358
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106787
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
NSC
84429
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
EVMPD
SUB09269MIG
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
CAS
5579-95-3
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
SMS_ID
100000083873
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
NCI_THESAURUS
C72592
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
FDA UNII
F57Y390K2N
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
PUBCHEM
21753
Created by admin on Fri Dec 15 15:11:44 GMT 2023 , Edited by admin on Fri Dec 15 15:11:44 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY