1,5-Naphthalenedisulfonic acid, 2-[[6-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]-, tetrasodium salt

CAS Name

1,5-Naphthalenedisulfonic acid, 2-[2-[6-[[4-chloro-6-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3-sulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:4)

Molecular Formula

C₃₁H₂₄ClN₇O₁₆S₅.4Na

Molecular Mass

1038.30

Other Names and Identifiers

InChI

InChI=1S/C31H24ClN7O16S5.4Na/c32-29-35-30(33-17-4-7-19(8-5-17)56(41,42)13-12-55-60(52,53)54)37-31(36-29)34-18-6-9-20-16(14-18)15-25(58(46,47)48)26(27(20)40)39-38-23-11-10-21-22(28(23)59(49,50)51)2-1-3-24(21)57(43,44)45;;;;/h1-11,14-15,40H,12-13H2,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H2,33,34,35,36,37);;;;

InChIKey

InChIKey=QGPSAJCDHHSRCQ-UHFFFAOYSA-N

Canonical SMILES

[Na].O=S(=O)(O)OCCS(=O)(=O)C1=CC=C(C=C1)NC2=NC(Cl)=NC(=N2)NC=3C=CC4=C(O)C(N=NC5=CC=C6C(C=CC=C6S(=O)(=O)O)=C5S(=O)(=O)O)=C(C=C4C3)S(=O)(=O)O

Other Names for this Substance