1-octyl-3-[10-(3-octylbenzimidazol-1-ium-1-yl)decyl]benzimidazol-3-ium

Systemtic Name: 1-octyl-3-[10-(3-octylbenzimidazol-1-ium-1-yl)decyl]benzimidazol-3-ium Openeye Name: 1-octyl-3-[10-(3-octylbenzimidazol-1-ium-1-yl)decyl]benzimidazol-3-ium CAS Name: 1-octyl-3-[10-(3-octyl-1-benzimidazol-1-iumyl)decyl]benzimidazol-3-ium IUPAC Name: 1-octyl-3-[10-(3-octylbenzimidazol-1-ium-1-yl)decyl]benzimidazol-3-ium Traditional Name: 1-octyl-3-[10-(3-octylbenzimidazol-1-ium-1-yl)decyl]benzimidazol-3-ium Formula: C40H64N4+2 MolecularWeight: 600.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=[N+](C2=CC=CC=C21)CCCCCCCCCC[N+]3=CN(C4=CC=CC=C43)CCCCCCCC

Isomeric SMILES

CCCCCCCCN1C=[N+](C2=CC=CC=C21)CCCCCCCCCC[N+]3=CN(C4=CC=CC=C43)CCCCCCCC

InChI

InChI=1S/C40H64N4/c1-3-5-7-9-15-23-31-41-35-43(39-29-21-19-27-37(39)41)33-25-17-13-11-12-14-18-26-34-44-36-42(32-24-16-10-8-6-4-2)38-28-20-22-30-40(38)44/h19-22,27-30,35-36H,3-18,23-26,31-34H2,1-2H3/q+2