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Details

Stereochemistry ACHIRAL
Molecular Formula C28H22N10O11S2
Molecular Weight 738.665
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 2-[[4-[2-[2-Amino-4-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-nitrophenyl]diazenyl]phenyl]amino]-5-nitrobenzenesulfonic acid

SMILES

CC1=NN(C(O)=C1\N=N\C2=C(C=C(\N=N\C3=CC=C(NC4=C(C=C(C=C4)[N+]([O-])=O)S(O)(=O)=O)C=C3)C(N)=C2)[N+]([O-])=O)C5=CC=C(C=C5)S(O)(=O)=O

InChI

InChIKey=HXZOIVRWDHUTQH-HSBKYFPUSA-N
InChI=1S/C28H22N10O11S2/c1-15-27(28(39)36(35-15)18-6-9-20(10-7-18)50(44,45)46)34-33-24-13-21(29)23(14-25(24)38(42)43)32-31-17-4-2-16(3-5-17)30-22-11-8-19(37(40)41)12-26(22)51(47,48)49/h2-14,30,39H,29H2,1H3,(H,44,45,46)(H,47,48,49)/b32-31+,34-33+

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[[4-[2-[2-Amino-4-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-nitrophenyl]diazenyl]phenyl]amino]-5-nitrobenzenesulfonic acid
Systematic Name English
Benzenesulfonic acid, 2-[[4-[2-[2-amino-4-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-nitrophenyl]diazenyl]phenyl]amino]-5-nitro-
Systematic Name English
Benzenesulfonic acid, 2-[[4-[[2-amino-4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-5-nitrophenyl]azo]phenyl]amino]-5-nitro-
Systematic Name English
Code System Code Type Description
FDA UNII
H6Z2Y26JGT
Created by admin on Sat Dec 16 20:09:38 GMT 2023 , Edited by admin on Sat Dec 16 20:09:38 GMT 2023
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CAS
85959-26-8
Created by admin on Sat Dec 16 20:09:38 GMT 2023 , Edited by admin on Sat Dec 16 20:09:38 GMT 2023
PRIMARY