Benzenesulfonic acid, 4,4′-[[[4-[(4-sulfophenyl)imino]-2,5-cyclohexadien-1-ylidene]methylene]bis(4,1-phenyleneimino)]bis-, sodium salt (1:2)

CAS Registry Number®

6415-98-1

CAS Name

Benzenesulfonic acid, 4,4′-[[[4-[(4-sulfophenyl)imino]-2,5-cyclohexadien-1-ylidene]methylene]bis(4,1-phenyleneimino)]bis-, sodium salt (1:2)

Molecular Formula

C37H29N3O9S3.2Na

Cite this Page

Benzenesulfonic acid, 4,4′-[[[4-[(4-sulfophenyl)imino]-2,5-cyclohexadien-1-ylidene]methylene]bis(4,1-phenyleneimino)]bis-, sodium salt (1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6415-98-1 (retrieved 2024-12-24) (CAS RN: 6415-98-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H29N3O9S3.2Na/c41-50(42,43)34-19-13-31(14-20-34)38-28-7-1-25(2-8-28)37(26-3-9-29(10-4-26)39-32-15-21-35(22-16-32)51(44,45)46)27-5-11-30(12-6-27)40-33-17-23-36(24-18-33)52(47,48)49;;/h1-24,38-39H,(H,41,42,43)(H,44,45,46)(H,47,48,49);;

InChIKey

InChIKey=IZVNCAULYYGBGT-UHFFFAOYSA-N

SMILES

C(C1=CC=C(NC2=CC=C(S(=O)(=O)O)C=C2)C=C1)(C3=CC=C(NC4=CC=C(S(=O)(=O)O)C=C4)C=C3)=C5C=CC(=NC6=CC=C(S(=O)(=O)O)C=C6)C=C5.[Na]

Canonical SMILES

[Na].O=S(=O)(O)C1=CC=C(N=C2C=CC(C=C2)=C(C3=CC=C(C=C3)NC4=CC=C(C=C4)S(=O)(=O)O)C5=CC=C(C=C5)NC6=CC=C(C=C6)S(=O)(=O)O)C=C1

Other Names for this Substance

  • Benzenesulfonic acid, 4,4′-[[[4-[(4-sulfophenyl)imino]-2,5-cyclohexadien-1-ylidene]methylene]bis(4,1-phenyleneimino)]bis-, sodium salt (1:2)
  • Benzenesulfonic acid, 4-[[4-[bis[4-[(4-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]amino]-, disodium salt
  • Disodium 4-[[4-[[4-[(4-sulfonatophenyl)amino]phenyl]-[4-[(4-sulfophenyl)amino]phenyl]methylidene]-1-cyclohexa-2,5-dienylidene]amino]benzenesulfonate
  • Disodium 4-[[4-[[4-(4-sulfonatophenyl)imino-1-cyclohexa-2,5-dienylidene]-[4-[(4-sulfophenyl)amino]phenyl]methyl]phenyl]amino]benzenesulfonate

Deleted or Replaced CAS Registry Numbers

38738-61-3, 1313437-30-7

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