Chemical Compound

39201-42-8

CAS Registry Number 39201-42-8
39201-42-8 chemical structure
Primary Record

39201-42-8

In stock
9,391 g
Purity
98.4 %
CAS
39201-42-8

Compound Identifiers & Properties

CAS
39201-42-8
PubChem CID
73555777
SMILES
CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCS(=O)(=O)[O-])C=C3N(C4=C(O3)C=CC(=C4)Cl)CCCS(=O)(=O)[O-].CC[NH+](CC)CC
Canonical SMILES
CCC(=Cc1oc2ccc(Cl)cc2[n+]1CCCS(=O)(=O)[O-])C=C1Oc2ccc(Cl)cc2N1CCCS(=O)(=O)[O-].CC[NH+](CC)CC

Names & Synonyms

  • 39201-42-8
  • Benzoxazolium, 5-chloro-2-[2-[[5-chloro-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)