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Details

Stereochemistry RACEMIC
Molecular Formula C16H10Cl2N4O7S2.2Na
Molecular Weight 551.289
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [ACID YELLOW 17]

SMILES

[Na+].[Na+].CC1=NN(C(=O)C1\N=N\C2=CC=C(C=C2)S([O-])(=O)=O)C3=C(Cl)C=C(C(Cl)=C3)S([O-])(=O)=O

InChI

InChIKey=FTZLWXQKVFFWLY-LLIZZRELSA-L
InChI=1S/C16H12Cl2N4O7S2.2Na/c1-8-15(20-19-9-2-4-10(5-3-9)30(24,25)26)16(23)22(21-8)13-6-12(18)14(7-11(13)17)31(27,28)29;;/h2-7,15H,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b20-19+;;

HIDE SMILES / InChI

Molecular Formula C16H10Cl2N4O7S2
Molecular Weight 505.309
Charge -2
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Molecular Formula Na
Molecular Weight 22.98976928
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 Wed Apr 02 05:03:45 GMT 2025
Edited
by admin
on Wed Apr 02 05:03:45 GMT 2025
Record UNII
Y428W9WW4D
Record Status alternative
Record Version
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Primary Definition