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Details

Stereochemistry RACEMIC
Molecular Formula C23H20N5O6S2.Na
Molecular Weight 549.555
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [ACID YELLOW 25]

SMILES

[Na+].CC1=NN(C(=O)C1\N=N\C2=CC=C(C)C(=C2)S(=O)(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)S([O-])(=O)=O

InChI

InChIKey=WYLWMAWLDZBLRN-QREUMGABSA-M
InChI=1S/C23H21N5O6S2.Na/c1-15-8-9-18(14-21(15)35(30,31)27-17-6-4-3-5-7-17)24-25-22-16(2)26-28(23(22)29)19-10-12-20(13-11-19)36(32,33)34;/h3-14,22,27H,1-2H3,(H,32,33,34);/q;+1/p-1/b25-24+;

HIDE SMILES / InChI

Molecular Formula C23H20N5O6S2
Molecular Weight 526.565
Charge -1
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 05:52:40 GMT 2025
Edited
by admin
on Wed Apr 02 05:52:40 GMT 2025
Record UNII
45Z95309RP
Record Status alternative
Record Version
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Primary Definition