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Details

Stereochemistry ACHIRAL
Molecular Formula C23H19ClN4O7S2
Molecular Weight 563.003
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ACID YELLOW 40 FREE ACID

SMILES

CC1=NN(C(O)=C1\N=N\C2=CC=C(OS(=O)(=O)C3=CC=C(C)C=C3)C=C2)C4=C(C=C(Cl)C=C4)S(O)(=O)=O

InChI

InChIKey=SZBYBGROZVFLQB-OCEACIFDSA-N
InChI=1S/C23H19ClN4O7S2/c1-14-3-10-19(11-4-14)37(33,34)35-18-8-6-17(7-9-18)25-26-22-15(2)27-28(23(22)29)20-12-5-16(24)13-21(20)36(30,31)32/h3-13,29H,1-2H3,(H,30,31,32)/b26-25+

HIDE SMILES / InChI

Molecular Formula C23H19ClN4O7S2
Molecular Weight 563.003
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:01:25 GMT 2023
Edited
by admin
on Sat Dec 16 10:01:25 GMT 2023
Record UNII
W9J78UER9B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID YELLOW 40 FREE ACID
Common Name English
BENZENESULFONIC ACID, 5-CHLORO-2-(4,5-DIHYDRO-3-METHYL-4-(2-(4-(((4-METHYLPHENYL)SULFONYL)OXY)PHENYL)DIAZENYL)-5-OXO-1H-PYRAZOL-1-YL)-
Systematic Name English
4-P-HYDROXYBENZENEAZO-1-P-CHLORO-O-SULFOPHENYL-3-METHYL-5-HYDROXYPYRAZOLE TOLUENE-P-SULFONYL ESTER
Systematic Name English
POLAR YELLOW FREE ACID
Common Name English
Code System Code Type Description
CAS
32674-42-3
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
FDA UNII
W9J78UER9B
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
CAS
1071757-51-1
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
ALTERNATIVE
Related Record Type Details
SALT/SOLVATE -> PARENT