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Details

Stereochemistry ACHIRAL
Molecular Formula C14H9N2O5S.Na
Molecular Weight 340.286
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 1,4-diamino-9,10-dihydro-9,10-dioxoanthracene-2-sulfonate

SMILES

[Na+].NC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(N)C(=C1)S([O-])(=O)=O

InChI

InChIKey=ALZAHMAJIWDUIY-UHFFFAOYSA-M
InChI=1S/C14H10N2O5S.Na/c15-8-5-9(22(19,20)21)12(16)11-10(8)13(17)6-3-1-2-4-7(6)14(11)18;/h1-5H,15-16H2,(H,19,20,21);/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 C14H9N2O5S
Molecular Weight 317.297
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 20:19:53 GMT 2023
Edited
by admin
on Sat Dec 16 20:19:53 GMT 2023
Record UNII
J8L3LD37SF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Sodium 1,4-diamino-9,10-dihydro-9,10-dioxoanthracene-2-sulfonate
Systematic Name English
2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
Systematic Name English
2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, sodium salt
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-305-9
Created by admin on Sat Dec 16 20:19:53 GMT 2023 , Edited by admin on Sat Dec 16 20:19:53 GMT 2023
PRIMARY
PUBCHEM
23663644
Created by admin on Sat Dec 16 20:19:53 GMT 2023 , Edited by admin on Sat Dec 16 20:19:53 GMT 2023
PRIMARY
FDA UNII
J8L3LD37SF
Created by admin on Sat Dec 16 20:19:53 GMT 2023 , Edited by admin on Sat Dec 16 20:19:53 GMT 2023
PRIMARY
CAS
6471-06-3
Created by admin on Sat Dec 16 20:19:53 GMT 2023 , Edited by admin on Sat Dec 16 20:19:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID40215055
Created by admin on Sat Dec 16 20:19:53 GMT 2023 , Edited by admin on Sat Dec 16 20:19:53 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE