1,3,6-Naphthalenetrisulfonic acid, 7-[[2-[(aminocarbonyl)amino]-4-[[4-chloro-6-[(2-sulfoethyl)amino]-1,3,5-triazin-2-yl]amino]phenyl]azo]-, tetrasodium salt

CAS Name

1,3,6-Naphthalenetrisulfonic acid, 7-[2-[2-[(aminocarbonyl)amino]-4-[[4-chloro-6-[(2-sulfoethyl)amino]-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-, sodium salt (1:4)

Molecular Formula

C₂₂H₂₀ClN₉O₁₃S₄.4Na

Molecular Mass

874.12

Other Names and Identifiers

InChI

InChI=1S/C22H20ClN9O13S4.4Na/c23-19-28-21(25-3-4-46(34,35)36)30-22(29-19)26-11-1-2-14(15(7-11)27-20(24)33)31-32-16-9-13-10(6-18(16)49(43,44)45)5-12(47(37,38)39)8-17(13)48(40,41)42;;;;/h1-2,5-9H,3-4H2,(H3,24,27,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H2,25,26,28,29,30);;;;

InChIKey

InChIKey=CERWQYLNMWDNPV-UHFFFAOYSA-N

Canonical SMILES

[Na].O=C(N)NC1=CC(=CC=C1N=NC=2C=C3C(C=C(C=C3S(=O)(=O)O)S(=O)(=O)O)=CC2S(=O)(=O)O)NC4=NC(Cl)=NC(=N4)NCCS(=O)(=O)O

Other Names for this Substance