Benzenesulfonic acid, 2-[2-(4-nitro-2-sulfophenyl)ethenyl]-5-[[4-[(4-sulfophenyl)azo]phenyl]-ONN-azoxy]-, trilithium salt

83968-54-1

CAS Name

Benzenesulfonic acid, 2-[2-(4-nitro-2-sulfophenyl)ethenyl]-5-[2-oxido-2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-, lithium salt (1:3)

Molecular Formula

C₂₆H₁₉N₅O₁₂S₃.3Li

Other Names and Identifiers

InChI

InChI=1S/C26H19N5O12S3.3Li/c32-30(22-11-6-19(7-12-22)27-28-20-8-13-24(14-9-20)44(35,36)37)29-21-5-3-17(25(15-21)45(38,39)40)1-2-18-4-10-23(31(33)34)16-26(18)46(41,42)43;;;/h1-16H,(H,35,36,37)(H,38,39,40)(H,41,42,43);;;

InChIKey

InChIKey=DWGAVYAPBDHSKX-UHFFFAOYSA-N

SMILES

C(=CC1=C(S(=O)(=O)O)C=C(N=N(=O)C2=CC=C(N=NC3=CC=C(S(=O)(=O)O)C=C3)C=C2)C=C1)C4=C(S(=O)(=O)O)C=C(N(=O)=O)C=C4.[Li]

Canonical SMILES

[Li].O=N(=O)C1=CC=C(C=CC2=CC=C(N=N(=O)C3=CC=C(N=NC4=CC=C(C=C4)S(=O)(=O)O)C=C3)C=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O

Other Names for this Substance