Chemical Compound

RefChem:789061

CAS Registry Number 63148-90-3
RefChem:789061 chemical structure
Primary Record

RefChem:789061

In stock
2,931 g
Purity
99.5 %
CAS
63148-90-3

Compound Identifiers & Properties

CAS
63148-90-3
PubChem CID
162995
SMILES
CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)O)C=C4N(C5=C(O4)C=CC(=C5)Cl)CCCS(=O)(=O)[O-].CCN(CC)CC
Canonical SMILES
CCC(=Cc1oc2ccc(-c3ccccc3)cc2[n+]1CCC(C)S(=O)(=O)O)C=C1Oc2ccc(Cl)cc2N1CCCS(=O)(=O)[O-].CCN(CC)CC

Names & Synonyms

  • RefChem:789061
  • 263-942-3
  • 63148-90-3
  • Benzoxazolium, 5-chloro-2-[2-[[5-phenyl-3-(3-sulfobutyl)-2(3H)-benzoxazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine
  • Hydrogen 5-chloro-2-(2-((5-phenyl-3-(3-sulphonatobutyl)-3H-benzoxazol-2-ylidene)methyl)but-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium, compound with triethylamine (1:1)
  • Hydrogen 5-chloro-2-[2-[[5-phenyl-3-(3-sulphonatobutyl)-3H-benzoxazol-2-ylidene]methyl]but-1-enyl]-3-(3-sulphonatopropyl)benzoxazolium, compound with triethylamine (1:1)