3,3'-Disulfopropyl-5,5'-Diphenyl-9-Ethyloxacarbocyanine Triethylammonium Salt
[CAS# 33898-60-1]

Identification

• Name: 3,3'-Disulfopropyl-5,5'-Diphenyl-9-Ethyloxacarbocyanine Triethylammonium Salt
• Synonyms: 5-Phenyl-2-(2-[(5-Phenyl-3-(3-Sulfopropyl)-2(3H)- Benzoxazolylidene)Methyl]- 1-Butenyl)-3-(3-Sulfopropyl)- Benzoxazolium Hydroxide, Inner Salt,Triethylamine Salt; 5-PHENYL-2-(2-[(5-PHENYL-3-(3-SULFOPROPYL)-2(3H)- BENZOXAZOLYLIDENE)METHYL]- 1-BUTENYL)-3-(3-SULFOPROPYL)- BENZOXAZOLIUM HYDROXIDE, INNER SALT,TRIETHYLAMINE SALT; 5-Phenyl-2-[2-[[5-Phenyl-3-(2-Sulfoethyl)-2(3H)-Benzoxazolylidene]Methyl]-1-Butenyl]-3-(2-Sulfoethyl)Benzoxazolium,Inner Salt,Compd. With N,N-Diethylethanamine
• Molecular Formula: C₄₃H₅₁N₃O₈S₂
• Molecular Weight: 802.01
• CAS Registry Number: 33898-60-1
• SMILES: CC/C(=C\c1oc2c([n+]1CCCS(=O)(=O)[O-])cc(cc2)c1ccccc1)/C=c/1\oc2c(n1CCCS(=O)(=O)O)cc(cc2)c1ccccc1.CCN(CC)CC
• InChI: 1S/C37H36N2O8S2.C6H15N/c1-2-27(23-36-38(19-9-21-48(40,41)42)32-25-30(15-17-34(32)46-36)28-11-5-3-6-12-28)24-37-39(20-10-22-49(43,44)45)33-26-31(16-18-35(33)47-37)29-13-7-4-8-14-29;1-4-7(5-2)6-3/