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Details

Stereochemistry ACHIRAL
Molecular Formula C10H13NO5S
Molecular Weight 259.279
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid

SMILES

CCS(=O)(=O)C1=C(N)C=C(OC)C(=C1)C(O)=O

InChI

InChIKey=OJVNCXHGGYYOPH-UHFFFAOYSA-N
InChI=1S/C10H13NO5S/c1-3-17(14,15)9-4-6(10(12)13)8(16-2)5-7(9)11/h4-5H,3,11H2,1-2H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C10H13NO5S
Molecular Weight 259.279
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 01:41:58 GMT 2023
Edited
by admin
on Sat Dec 16 01:41:58 GMT 2023
Record UNII
QE5K498QLP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid
Systematic Name English
4-Amino-5-(ethylsulphonyl)-o-anisic acid
Common Name English
4-Amino-5-(ethylsulfonyl)-2-methoxybenzoic acid
Systematic Name English
Benzoic acid, 4-amino-5-(ethylsulfonyl)-2-methoxy-
Systematic Name English
Code System Code Type Description
CAS
71675-87-1
Created by admin on Sat Dec 16 01:41:58 GMT 2023 , Edited by admin on Sat Dec 16 01:41:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
275-833-8
Created by admin on Sat Dec 16 01:41:58 GMT 2023 , Edited by admin on Sat Dec 16 01:41:58 GMT 2023
PRIMARY
FDA UNII
QE5K498QLP
Created by admin on Sat Dec 16 01:41:58 GMT 2023 , Edited by admin on Sat Dec 16 01:41:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID80992277
Created by admin on Sat Dec 16 01:41:58 GMT 2023 , Edited by admin on Sat Dec 16 01:41:58 GMT 2023
PRIMARY
PUBCHEM
3018232
Created by admin on Sat Dec 16 01:41:58 GMT 2023 , Edited by admin on Sat Dec 16 01:41:58 GMT 2023
PRIMARY