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)
CAS Registry Number®
79809-27-1
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
C31H24ClN7O16S5.4NaCite this Page
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). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=79809-27-1 (retrieved ) (CAS RN: 79809-27-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).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
SMILES
S(=O)(=O)(O)C=1C2=C(C(S(=O)(=O)O)=CC=C2)C=CC1N=NC=3C(S(=O)(=O)O)=CC4=C(C3O)C=CC(NC=5N=C(NC6=CC=C(S(CCOS(=O)(=O)O)(=O)=O)C=C6)N=C(Cl)N5)=C4.[Na]
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
- 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)
- 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
