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Details

Stereochemistry ACHIRAL
Molecular Formula C22H18ClN5O6S2
Molecular Weight 547.991
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ACID YELLOW 29 FREE ACID

SMILES

CC1=NN(C(O)=C1\N=N\C2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3)C4=CC(=CC=C4Cl)S(O)(=O)=O

InChI

InChIKey=MZVUUOAIZDGPJI-OCOZRVBESA-N
InChI=1S/C22H18ClN5O6S2/c1-14-21(22(29)28(26-14)20-13-18(36(32,33)34)10-11-19(20)23)25-24-16-8-5-9-17(12-16)35(30,31)27-15-6-3-2-4-7-15/h2-13,27,29H,1H3,(H,32,33,34)/b25-24+

HIDE SMILES / InChI

Molecular Formula C22H18ClN5O6S2
Molecular Weight 547.991
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 13:21:02 GMT 2023
Edited
by admin
on Sat Dec 16 13:21:02 GMT 2023
Record UNII
EQ516Y673U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID YELLOW 29 FREE ACID
Common Name English
BENZENESULFONIC ACID, 4-CHLORO-3-(4,5-DIHYDRO-3-METHYL-5-OXO-4-(2-(3-((PHENYLAMINO)SULFONYL)PHENYL)DIAZENYL)-1H-PYRAZOL-1-YL)-
Systematic Name English
BENZENESULFONIC ACID, 4-CHLORO-3-(4,5-DIHYDRO-3-METHYL-5-OXO-4-((3-((PHENYLAMINO)SULFONYL)PHENYL)AZO)-1H-PYRAZOL-1-YL)-
Systematic Name English
Code System Code Type Description
CAS
34063-75-7
Created by admin on Sat Dec 16 13:21:02 GMT 2023 , Edited by admin on Sat Dec 16 13:21:02 GMT 2023
PRIMARY
FDA UNII
EQ516Y673U
Created by admin on Sat Dec 16 13:21:02 GMT 2023 , Edited by admin on Sat Dec 16 13:21:02 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT