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Details

Stereochemistry ACHIRAL
Molecular Formula C20H13N3O8S2.2Na
Molecular Weight 533.442
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DISODIUM 1-AMINO-4-((3-AMINO-4-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9

SMILES

[Na+].[Na+].NC1=CC(NC2=CC(=C(N)C3=C2C(=O)C4=C(C=CC=C4)C3=O)S([O-])(=O)=O)=CC=C1S([O-])(=O)=O

InChI

InChIKey=ISNVDXVHWSVHMS-UHFFFAOYSA-L
InChI=1S/C20H15N3O8S2.2Na/c21-12-7-9(5-6-14(12)32(26,27)28)23-13-8-15(33(29,30)31)18(22)17-16(13)19(24)10-3-1-2-4-11(10)20(17)25;;/h1-8,23H,21-22H2,(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2

HIDE SMILES / InChI

Approval Year

Name Type Language
DISODIUM 1-AMINO-4-((3-AMINO-4-SULFOPHENYL)AMINO)-9,10-DIHYDRO-9
Common Name English
2-ANTHRACENESULFONIC ACID, 1-AMINO-4-(3-AMINO-4-SULFOANILINO)-9,10-DIHYDRO-9,10-DIOXO-, DISODIUM SALT
Preferred Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-735-7
Created by admin on Mon Mar 31 19:57:40 GMT 2025 , Edited by admin on Mon Mar 31 19:57:40 GMT 2025
PRIMARY
CAS
6691-06-1
Created by admin on Mon Mar 31 19:57:40 GMT 2025 , Edited by admin on Mon Mar 31 19:57:40 GMT 2025
PRIMARY
PUBCHEM
165525
Created by admin on Mon Mar 31 19:57:40 GMT 2025 , Edited by admin on Mon Mar 31 19:57:40 GMT 2025
PRIMARY
FDA UNII
3IP173C5CE
Created by admin on Mon Mar 31 19:57:40 GMT 2025 , Edited by admin on Mon Mar 31 19:57:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID10217061
Created by admin on Mon Mar 31 19:57:40 GMT 2025 , Edited by admin on Mon Mar 31 19:57:40 GMT 2025
PRIMARY