(4beta,8alpha,9R,3'''alpha,8'''alpha,9'''R)-1,1'-[2,7-Naphthalenediylbis(Methylene)]Bis[9-(Allyloxy)-10,11-Dihydrocinchonan-1-Ium] Dibromide
[CAS# 480427-57-4]

Identification

• Name: (4beta,8alpha,9R,3'''alpha,8'''alpha,9'''R)-1,1'-[2,7-Naphthalenediylbis(Methylene)]Bis[9-(Allyloxy)-10,11-Dihydrocinchonan-1-Ium] Dibromide
• Synonyms: (4β,8α,9R,3'''α,8'''α,9'''R)-1,1'-(2,7-Naphthalindiyldimethylen)bis[9-(allyloxy)-10,11-dihydrocinchonan-1-ium]dibromid; (4β,8α,9R,3'''α,8'''α,9'''R)-1,1'-[2,7-Naphthalenediylbis(methylene)]bis[9-(allyloxy)-10,11-dihydrocinchonan-1-ium] dibromide; Cinchonan-1-ium, 1,1'-[2,7-naphthalenediylbis(methylene)]bis[10,11-dihydro-9-(2-propen-1-yloxy)-, bromide, (4β,8α,9R,3'''α,8'''α,9'''R)- (1:2)
• Molecular Formula: C₅₆H₆₆Br₂N₄O₂
• Molecular Weight: 986.96
• CAS Registry Number: 480427-57-4
• SMILES: CC[C@@H]1C[N+]2(CC[C@@H]1C[C@H]2[C@@H](c3ccnc4c3cccc4)OCC=C)Cc5ccc6ccc(cc6c5)C[N+]78CC[C@@H](C[C@H]7[C@@H](c9ccnc1c9cccc1)OCC=C)[C@H](C8)CC.[Br-].[Br-]
• InChI: 1S/C56H66N4O2.2BrH/c1-5-29-61-55(49-21-25-57-51-15-11-9-13-47(49)51)53-33-44-23-27-59(53,37-41(44)7-3)35-39-17-19-43-20-18-40(32-46(43)31-39)36-60-28-24-45(42(8-4)38-60)34-54(60)56(62-30-6-2)50-22-26-58-52-16-12-10-14-48(50)52;;/h5-6,9-22,25-26,31-32,41-42,44-45,53-56H,1-2,7-8,23-24,27-30,33-38H2,3-4H3;2*1H/q+2;;/p-2/t41-,42+,44-,45+,53-,54-,55+,56+,59?,60?;;/m0../s1
• InChIKey: AXFUWHSRJPMLNZ-LZZJOUQRSA-L

Properties

• Refractive index: (Cal.)