2-[3-[1-[2-Acetoxy-3-Sulphonatopropyl]-5,6-Dichloro-3-Ethyl-1,3-Dihydro-2H-Benzimidazol-2-Ylidene]Prop-1-Enyl]-3-Ethylbenzoxazolium
[CAS# 68239-65-6]

Identification

• Name: 2-[3-[1-[2-Acetoxy-3-Sulphonatopropyl]-5,6-Dichloro-3-Ethyl-1,3-Dihydro-2H-Benzimidazol-2-Ylidene]Prop-1-Enyl]-3-Ethylbenzoxazolium
• Synonyms: 2-Acetoxy-3-[(2E)-5,6-Dichloro-3-Ethyl-2-[(E)-3-(3-Ethyl-1,3-Benzoxazol-3-Ium-2-Yl)Prop-2-Enylidene]Benzimidazol-1-Yl]Propane-1-Sulfonate; 2-Acetoxy-3-[(2E)-5,6-Dichloro-3-Ethyl-2-[(E)-3-(3-Ethyl-1,3-Benzoxazol-3-Ium-2-Yl)Prop-2-Enylidene]-1-Benzimidazolyl]Propane-1-Sulfonate
• Molecular Formula: C₂₆H₂₇Cl₂N₃O₆S
• Molecular Weight: 580.48
• CAS Registry Number: 68239-65-6
• EINECS: 269-458-9
• SMILES: C2=C1N(C(N(C1=CC(=C2Cl)Cl)CC)=CC=CC4=[N+](C3=CC=CC=C3O4)CC)CC(OC(=O)C)C[S]([O-])(=O)=O
• InChI: 1S/C26H27Cl2N3O6S/c1-4-29-22-13-19(27)20(28)14-23(22)31(15-18(36-17(3)32)16-38(33,34)35)25(29)11-8-12-26-30(5-2)21-9-6-7-10-24(21)37-26/h6-14,18H,4-5,15-16H2,1-3H3
• InChIKey: VUWMFLLNEXBFLA-UHFFFAOYSA-N