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Details

Stereochemistry ACHIRAL
Molecular Formula C14H10N2O5S
Molecular Weight 318.305
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,4-Diamino-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid

SMILES

NC1=CC(=C(N)C2=C1C(=O)C3=C(C=CC=C3)C2=O)S(O)(=O)=O

InChI

InChIKey=DZXNARMBWJFBGD-UHFFFAOYSA-N
InChI=1S/C14H10N2O5S/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)

HIDE SMILES / InChI

Molecular Formula C14H10N2O5S
Molecular Weight 318.305
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 Tue Apr 01 18:46:13 GMT 2025
Edited
by admin
on Tue Apr 01 18:46:13 GMT 2025
Record UNII
32GAA24YNW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,4-Diamino-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid
Systematic Name English
1,4-Diamino-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
Preferred Name English
2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-
Systematic Name English
Code System Code Type Description
PUBCHEM
77725
Created by admin on Tue Apr 01 18:46:13 GMT 2025 , Edited by admin on Tue Apr 01 18:46:13 GMT 2025
PRIMARY
EPA CompTox
DTXSID20193948
Created by admin on Tue Apr 01 18:46:13 GMT 2025 , Edited by admin on Tue Apr 01 18:46:13 GMT 2025
PRIMARY
ECHA (EC/EINECS)
223-846-4
Created by admin on Tue Apr 01 18:46:13 GMT 2025 , Edited by admin on Tue Apr 01 18:46:13 GMT 2025
PRIMARY
CAS
4095-85-6
Created by admin on Tue Apr 01 18:46:13 GMT 2025 , Edited by admin on Tue Apr 01 18:46:13 GMT 2025
PRIMARY
FDA UNII
32GAA24YNW
Created by admin on Tue Apr 01 18:46:13 GMT 2025 , Edited by admin on Tue Apr 01 18:46:13 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT