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Details

Stereochemistry ACHIRAL
Molecular Formula C11H17ClNO2S.Br
Molecular Weight 342.68
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [2-(4-chlorobenzenesulfonyl)ethyl]trimethylazanium bromide

SMILES

[Br-].C[N+](C)(C)CCS(=O)(=O)C1=CC=C(Cl)C=C1

InChI

InChIKey=ZPOLPYSVBUQCJH-UHFFFAOYSA-M
InChI=1S/C11H17ClNO2S.BrH/c1-13(2,3)8-9-16(14,15)11-6-4-10(12)5-7-11;/h4-7H,8-9H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H17ClNO2S
Molecular Weight 262.776
Charge 1
Count
Stereochemistry RACEMIC
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 19:07:26 GMT 2023
Edited
by admin
on Sat Dec 16 19:07:26 GMT 2023
Record UNII
9X9DNF8UTP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
[2-(4-chlorobenzenesulfonyl)ethyl]trimethylazanium bromide
Systematic Name English
AMMONIUM, (2-(P-CHLOROPHENYLSULFONYL)ETHYL)TRIMETHYL-, BROMIDE
Common Name English
2-(p-chlorophenylsulfonyl)ethyltrimethylammonium bromide
Systematic Name English
NSC-202612
Code English
Ethanaminium, 2-[(4-chlorophenyl)sulfonyl]-N,N,N-trimethyl-, bromide (1:1)
Systematic Name English
Ethanaminium, 2-[(4-chlorophenyl)sulfonyl]-N,N,N-trimethyl-, bromide
Systematic Name English
Code System Code Type Description
PUBCHEM
52005
Created by admin on Sat Dec 16 19:07:26 GMT 2023 , Edited by admin on Sat Dec 16 19:07:26 GMT 2023
PRIMARY
FDA UNII
9X9DNF8UTP
Created by admin on Sat Dec 16 19:07:26 GMT 2023 , Edited by admin on Sat Dec 16 19:07:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID70994462
Created by admin on Sat Dec 16 19:07:26 GMT 2023 , Edited by admin on Sat Dec 16 19:07:26 GMT 2023
PRIMARY
CAS
73664-00-3
Created by admin on Sat Dec 16 19:07:26 GMT 2023 , Edited by admin on Sat Dec 16 19:07:26 GMT 2023
PRIMARY
NSC
202612
Created by admin on Sat Dec 16 19:07:26 GMT 2023 , Edited by admin on Sat Dec 16 19:07:26 GMT 2023
PRIMARY