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Details

Stereochemistry ACHIRAL
Molecular Formula C10H14NO4S.Na
Molecular Weight 267.277
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 3-(2-amino-4-methylphenoxy)propane-1-sulfonate

SMILES

[Na+].CC1=CC=C(OCCCS([O-])(=O)=O)C(N)=C1

InChI

InChIKey=RJAJSFDNPPEWPS-UHFFFAOYSA-M
InChI=1S/C10H15NO4S.Na/c1-8-3-4-10(9(11)7-8)15-5-2-6-16(12,13)14;/h3-4,7H,2,5-6,11H2,1H3,(H,12,13,14);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-Propanesulfonic acid, 3-(2-amino-4-methylphenoxy)-, sodium salt (1:1)
Preferred Name English
Sodium 3-(2-amino-4-methylphenoxy)propane-1-sulfonate
Systematic Name English
Code System Code Type Description
FDA UNII
T6KBH9GRF6
Created by admin on Wed Apr 02 17:37:46 GMT 2025 , Edited by admin on Wed Apr 02 17:37:46 GMT 2025
PRIMARY
CAS
1609690-19-8
Created by admin on Wed Apr 02 17:37:46 GMT 2025 , Edited by admin on Wed Apr 02 17:37:46 GMT 2025
PRIMARY
NIH
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