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Details

Stereochemistry ACHIRAL
Molecular Formula C7H3Cl2NO6S
Molecular Weight 300.073
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO-5-CHLOROSULFONYL-3-NITROBENZOIC ACID

SMILES

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

InChI

InChIKey=AFRAGFLBINOHDV-UHFFFAOYSA-N
InChI=1S/C7H3Cl2NO6S/c8-6-4(10(13)14)1-3(7(11)12)2-5(6)17(9,15)16/h1-2H,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C7H3Cl2NO6S
Molecular Weight 300.073
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 11:52:56 GMT 2023
Edited
by admin
on Sat Dec 16 11:52:56 GMT 2023
Record UNII
T9UC8TJB58
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO-5-CHLOROSULFONYL-3-NITROBENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-CHLORO-3-(CHLOROSULPHONYL)-5-NITRO-
Systematic Name English
4-CHLORO-3-(CHLOROSULPHONYL)-5-NITROBENZOIC ACID
Systematic Name English
4-CHLORO-5-CHLOROSULPHONYL-3-NITROBENZOIC ACID
Systematic Name English
4-CHLORO-3-(CHLOROSULFONYL)-5-NITROBENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-CHLORO-3-(CHLOROSULFONYL)-5-NITRO-
Systematic Name English
Code System Code Type Description
FDA UNII
T9UC8TJB58
Created by admin on Sat Dec 16 11:52:56 GMT 2023 , Edited by admin on Sat Dec 16 11:52:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID90177432
Created by admin on Sat Dec 16 11:52:56 GMT 2023 , Edited by admin on Sat Dec 16 11:52:56 GMT 2023
PRIMARY
PUBCHEM
89892
Created by admin on Sat Dec 16 11:52:56 GMT 2023 , Edited by admin on Sat Dec 16 11:52:56 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-309-3
Created by admin on Sat Dec 16 11:52:56 GMT 2023 , Edited by admin on Sat Dec 16 11:52:56 GMT 2023
PRIMARY
CAS
22892-95-1
Created by admin on Sat Dec 16 11:52:56 GMT 2023 , Edited by admin on Sat Dec 16 11:52:56 GMT 2023
PRIMARY