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Details

Stereochemistry ACHIRAL
Molecular Formula C10H15NO8S2
Molecular Weight 341.358
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((4-Amino-2,5-dimethoxyphenyl)sulfonyl)ethyl hydrogen sulfate

SMILES

COC1=CC(N)=C(OC)C=C1S(=O)(=O)CCOS(O)(=O)=O

InChI

InChIKey=YTIYUMNTOZTPCC-UHFFFAOYSA-N
InChI=1S/C10H15NO8S2/c1-17-8-6-10(9(18-2)5-7(8)11)20(12,13)4-3-19-21(14,15)16/h5-6H,3-4,11H2,1-2H3,(H,14,15,16)

HIDE SMILES / InChI

Molecular Formula C10H15NO8S2
Molecular Weight 341.358
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 12:29:48 GMT 2023
Edited
by admin
on Sat Dec 16 12:29:48 GMT 2023
Record UNII
BXQ97AF88J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((4-Amino-2,5-dimethoxyphenyl)sulfonyl)ethyl hydrogen sulfate
Systematic Name English
Ethanol, 2-[(4-amino-2,5-dimethoxyphenyl)sulfonyl]-, hydrogen sulfate (ester)
Systematic Name English
Ethanol, 2-[(4-amino-2,5-dimethoxyphenyl)sulfonyl]-, 1-(hydrogen sulfate)
Systematic Name English
Code System Code Type Description
CAS
26672-24-2
Created by admin on Sat Dec 16 12:29:48 GMT 2023 , Edited by admin on Sat Dec 16 12:29:48 GMT 2023
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EPA CompTox
DTXSID8067232
Created by admin on Sat Dec 16 12:29:48 GMT 2023 , Edited by admin on Sat Dec 16 12:29:48 GMT 2023
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PUBCHEM
117838
Created by admin on Sat Dec 16 12:29:48 GMT 2023 , Edited by admin on Sat Dec 16 12:29:48 GMT 2023
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FDA UNII
BXQ97AF88J
Created by admin on Sat Dec 16 12:29:48 GMT 2023 , Edited by admin on Sat Dec 16 12:29:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
247-896-1
Created by admin on Sat Dec 16 12:29:48 GMT 2023 , Edited by admin on Sat Dec 16 12:29:48 GMT 2023
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