5-Amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-2,7-naphthalenedisulfonic acid

CAS Registry Number®

117-45-3

CAS Name

5-Amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-2,7-naphthalenedisulfonic acid

Molecular Formula

C34H27N5O17S5

Molecular Mass

937.93

Cite this Page

5-Amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-2,7-naphthalenedisulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=117-45-3 (retrieved 2024-11-29) (CAS RN: 117-45-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C34H27N5O17S5/c1-17-8-26(37-39-33-30(60(50,51)52)12-19-11-21(57(41,42)43)13-24(35)31(19)34(33)40)28(55-2)16-25(17)36-38-27-14-22(58(44,45)46)9-18-10-23(59(47,48)49)15-29(32(18)27)56-61(53,54)20-6-4-3-5-7-20/h3-16,40H,35H2,1-2H3,(H,41,42,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)

InChIKey

InChIKey=ZATSCOAQBZUOPT-UHFFFAOYSA-N

SMILES

O(S(=O)(=O)C1=CC=CC=C1)C=2C3=C(C=C(S(=O)(=O)O)C2)C=C(S(=O)(=O)O)C=C3N=NC4=CC(OC)=C(N=NC=5C(S(=O)(=O)O)=CC6=C(C5O)C(N)=CC(S(=O)(=O)O)=C6)C=C4C

Canonical SMILES

O=S(=O)(O)C=1C=C(N=NC=2C=C(OC)C(N=NC3=C(O)C4=C(N)C=C(C=C4C=C3S(=O)(=O)O)S(=O)(=O)O)=CC2C)C5=C(OS(=O)(=O)C=6C=CC=CC6)C=C(C=C5C1)S(=O)(=O)O

Other Names for this Substance

  • 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-
  • 2,7-Naphthalenedisulfonic acid, 5-amino-4,5′-dihydroxy-3,4′-[(2-methoxy-5-methyl-p-phenylene)bis(azo)]di-, 5′-benzenesulfonate
  • 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[2-methoxy-5-methyl-4-[[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]azo]phenyl]azo]-
  • 5-Amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-2,7-naphthalenedisulfonic acid

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