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Details

Stereochemistry ACHIRAL
Molecular Formula C11H13NO6S
Molecular Weight 287.289
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(ACETAMIDO)-4-((2-HYDROXYETHYL)SULFONYL)BENZOIC ACID

SMILES

CC(=O)NC1=CC(=CC=C1C(O)=O)S(=O)(=O)CCO

InChI

InChIKey=YGPJTGQFHGCTNC-UHFFFAOYSA-N
InChI=1S/C11H13NO6S/c1-7(14)12-10-6-8(19(17,18)5-4-13)2-3-9(10)11(15)16/h2-3,6,13H,4-5H2,1H3,(H,12,14)(H,15,16)

HIDE SMILES / InChI

Molecular Formula C11H13NO6S
Molecular Weight 287.289
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 12:22:34 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:34 GMT 2023
Record UNII
Y66RV7CB3T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(ACETAMIDO)-4-((2-HYDROXYETHYL)SULFONYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, 2-(ACETYLAMINO)-4-((2-HYDROXYETHYL)SULFONYL)-
Systematic Name English
BENZOIC ACID, 2-(ACETYLAMINO)-4-((2-HYDROXYETHYL)SULPHONYL)-
Systematic Name English
2-(ACETAMIDO)-4-((2-HYDROXYETHYL)SULPHONYL)BENZOIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
Y66RV7CB3T
Created by admin on Sat Dec 16 12:22:34 GMT 2023 , Edited by admin on Sat Dec 16 12:22:34 GMT 2023
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CAS
84712-88-9
Created by admin on Sat Dec 16 12:22:34 GMT 2023 , Edited by admin on Sat Dec 16 12:22:34 GMT 2023
PRIMARY
ECHA (EC/EINECS)
283-778-6
Created by admin on Sat Dec 16 12:22:34 GMT 2023 , Edited by admin on Sat Dec 16 12:22:34 GMT 2023
PRIMARY
PUBCHEM
3020093
Created by admin on Sat Dec 16 12:22:34 GMT 2023 , Edited by admin on Sat Dec 16 12:22:34 GMT 2023
PRIMARY
EPA CompTox
DTXSID10233726
Created by admin on Sat Dec 16 12:22:34 GMT 2023 , Edited by admin on Sat Dec 16 12:22:34 GMT 2023
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