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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H20NO5S.Na
Molecular Weight 337.367
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2',6'-DIETHYL-N-METHOXYMETHYL-2-SULFOACETANILIDE

SMILES

[Na+].CCC1=CC=CC(CC)=C1N(COC)C(=O)CS([O-])(=O)=O

InChI

InChIKey=DXLRATMHMHJKHK-UHFFFAOYSA-M
InChI=1S/C14H21NO5S.Na/c1-4-11-7-6-8-12(5-2)14(11)15(10-20-3)13(16)9-21(17,18)19;/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C14H20NO5S
Molecular Weight 314.377
Charge -1
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 08:38:32 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:32 GMT 2023
Record UNII
0C45597VUV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 2',6'-DIETHYL-N-METHOXYMETHYL-2-SULFOACETANILIDE
Systematic Name English
ALACHLOR ESA, SODIUM SALT
Common Name English
ETHANESULFONIC ACID, 2-((2,6-DIETHYLPHENYL)(METHOXYMETHYL)AMINO)-2-OXO-, SODIUM SALT
Common Name English
2',6'-DIETHYL-N-METHOXYMETHYL-2-SULFOACETANILIDE, SODIUM SALT
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 600064
Created by admin on Sat Dec 16 08:38:32 GMT 2023 , Edited by admin on Sat Dec 16 08:38:32 GMT 2023
Code System Code Type Description
FDA UNII
0C45597VUV
Created by admin on Sat Dec 16 08:38:32 GMT 2023 , Edited by admin on Sat Dec 16 08:38:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID0052837
Created by admin on Sat Dec 16 08:38:32 GMT 2023 , Edited by admin on Sat Dec 16 08:38:32 GMT 2023
PRIMARY
PUBCHEM
23664984
Created by admin on Sat Dec 16 08:38:32 GMT 2023 , Edited by admin on Sat Dec 16 08:38:32 GMT 2023
PRIMARY
CAS
140939-15-7
Created by admin on Sat Dec 16 08:38:32 GMT 2023 , Edited by admin on Sat Dec 16 08:38:32 GMT 2023
PRIMARY