Chemical Compound

RefChem:566439

CAS Registry Number 57532-33-9
RefChem:566439 chemical structure
Primary Record

RefChem:566439

In stock
8,860 g
Purity
98.4 %
CAS
57532-33-9

Compound Identifiers & Properties

CAS
57532-33-9
PubChem CID
6436681
SMILES
CC/C(=C/C1[NH+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCCS(=O)(=O)[O-])/C=C/4\N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCCS(=O)(=O)[O-].CC[NH+](CC)CC
Canonical SMILES
CCC(=C/C1Oc2ccc(-c3ccccc3)cc2[NH+]1CCCCS(=O)(=O)[O-])/C=C1/Oc2ccc(-c3ccccc3)cc2N1CCCCS(=O)(=O)[O-].CC[NH+](CC)CC

Names & Synonyms

  • RefChem:566439
  • AC1O5M6H
  • EINECS 260-797-8
  • CID6436681
  • Benzoxazolium, 5-phenyl-2-(2-((5-phenyl-3-(4-sulfobutyl)-2(3H)-benzoxazolylidene)methyl)-1-buten-1-yl)-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
  • Benzoxazolium, 5-phenyl-2-(2-((5-phenyl-3-(4-sulfobutyl)-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
  • 4-[5-phenyl-2-[(Z)-2-[(E)-[5-phenyl-3-(4-sulfonatobutyl)-1,3-benzoxazol-2-ylidene]methyl]but-1-enyl]-2,3-dihydro-1,3-benzoxazol-3-ium-3-yl]butane-1-sulfonate; triethylazanium
  • 57532-33-9
  • Benzoxazolium, 5-phenyl-2-[2-[[5-phenyl-3-(4-sulfobutyl)-2(3H)-benzoxazolylidene]methyl]-1-buten-1-yl]-3-(4-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
  • Hydrogen 5-phenyl-2-(2-((5-phenyl-3-(4-sulphonatobutyl)-3H-benzoxazol-2-ylidene)methyl)but-1-enyl)-3-(4-sulphonatobutyl)benzoxazolium, compound with triethylamine (1:1)