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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H9ClN2O4S
Molecular Weight 264.686
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Chloro-N,N-dimethyl-3-nitrobenzenesulfonamide

SMILES

CN(C)S(=O)(=O)C1=CC(=C(Cl)C=C1)[N+]([O-])=O

InChI

InChIKey=HBTAOSGHCXUEKI-UHFFFAOYSA-N
InChI=1S/C8H9ClN2O4S/c1-10(2)16(14,15)6-3-4-7(9)8(5-6)11(12)13/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H9ClN2O4S
Molecular Weight 264.686
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 Sat Dec 16 12:31:41 GMT 2023
Edited
by admin
on Sat Dec 16 12:31:41 GMT 2023
Record UNII
Y4SEF4NTW3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Chloro-N,N-dimethyl-3-nitrobenzenesulfonamide
Systematic Name English
Benzenesulphonamide, 4-chloro-N,N-dimethyl-3-nitro-
Systematic Name English
NSC-231629
Code English
Benzenesulfonamide, 4-chloro-N,N-dimethyl-3-nitro-
Systematic Name English
4-Chloro-N,N-dimethyl-3-nitrobenzenesulphonamide
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID4059671
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY
PUBCHEM
67300
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY
NSC
231629
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
205-295-1
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY
CAS
137-47-3
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY
FDA UNII
Y4SEF4NTW3
Created by admin on Sat Dec 16 12:31:41 GMT 2023 , Edited by admin on Sat Dec 16 12:31:41 GMT 2023
PRIMARY