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Details

Stereochemistry ACHIRAL
Molecular Formula C23H20N2O5S
Molecular Weight 436.48
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Amino-9,10-dihydro-9,10-dioxo-4-(2,4,6-trimethylanilino)anthracene-2-sulfonic acid

SMILES

CC1=CC(C)=C(NC2=C3C(=O)C4=C(C=CC=C4)C(=O)C3=C(N)C(=C2)S(O)(=O)=O)C(C)=C1

InChI

InChIKey=YKHGPGKCMQFZSK-UHFFFAOYSA-N
InChI=1S/C23H20N2O5S/c1-11-8-12(2)21(13(3)9-11)25-16-10-17(31(28,29)30)20(24)19-18(16)22(26)14-6-4-5-7-15(14)23(19)27/h4-10,25H,24H2,1-3H3,(H,28,29,30)

HIDE SMILES / InChI

Molecular Formula C23H20N2O5S
Molecular Weight 436.48
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 20:38:05 GMT 2025
Edited
by admin
on Tue Apr 01 20:38:05 GMT 2025
Record UNII
8H8J7M2T6A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Amino-9,10-dihydro-9,10-dioxo-4-(2,4,6-trimethylanilino)anthracene-2-sulfonic acid
Systematic Name English
1-Amino-9,10-dihydro-9,10-dioxo-4-[(2,4,6-trimethylphenyl)amino]-2-anthracenesulfonic acid
Preferred Name English
2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-9,10-dioxo-4-[(2,4,6-trimethylphenyl)amino]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
217-394-7
Created by admin on Tue Apr 01 20:38:05 GMT 2025 , Edited by admin on Tue Apr 01 20:38:05 GMT 2025
PRIMARY
CAS
1833-57-4
Created by admin on Tue Apr 01 20:38:05 GMT 2025 , Edited by admin on Tue Apr 01 20:38:05 GMT 2025
PRIMARY
PUBCHEM
22902
Created by admin on Tue Apr 01 20:38:05 GMT 2025 , Edited by admin on Tue Apr 01 20:38:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID20171408
Created by admin on Tue Apr 01 20:38:05 GMT 2025 , Edited by admin on Tue Apr 01 20:38:05 GMT 2025
PRIMARY
FDA UNII
8H8J7M2T6A
Created by admin on Tue Apr 01 20:38:05 GMT 2025 , Edited by admin on Tue Apr 01 20:38:05 GMT 2025
PRIMARY
Related Record Type Details
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