5-Ethoxy-2-[2-[(3-Ethyl-5-Methyl-3H-Benzoselenazol-2-Ylidene)Methyl]But-1-Enyl]-3-(3-Sulphonatopropyl)Benzothiazolium
[CAS# 55811-25-1]

Identification

• Name: 5-Ethoxy-2-[2-[(3-Ethyl-5-Methyl-3H-Benzoselenazol-2-Ylidene)Methyl]But-1-Enyl]-3-(3-Sulphonatopropyl)Benzothiazolium
• Synonyms: 3-[(2Z)-5-Ethoxy-2-[(2E)-2-[(3-Ethyl-5-Methyl-1,3-Benzoselenazol-3-Ium-2-Yl)Methylene]Butylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonate; 3-[(2Z)-5-Ethoxy-2-[(E)-2-Ethyl-3-(3-Ethyl-5-Methyl-1,3-Benzoselenazol-3-Ium-2-Yl)Prop-2-Enylidene]-1,3-Benzothiazol-3-Yl]Propane-1-Sulfonate
• Molecular Formula: C₂₇H₃₂N₂O₄S₂Se
• Molecular Weight: 591.64
• CAS Registry Number: 55811-25-1
• EINECS: 259-833-5
• SMILES: C2=C1[N+](=C(SC1=CC=C2OCC)C=C(C=C4[Se]C3=CC=C(C=C3N4CC)C)CC)CCC[S]([O-])(=O)=O
• InChI: 1S/C27H32N2O4S2Se/c1-5-20(17-27-28(6-2)23-15-19(4)9-12-25(23)36-27)16-26-29(13-8-14-35(30,31)32)22-18-21(33-7-3)10-11-24(22)34-26/h9-12,15-18H,5-8,13-14H2,1-4H3
• InChIKey: KTQCCGGJPFHOIH-UHFFFAOYSA-N