1-methyl-3-[1-(1-methyl-1-octyl-indol-1-ium-3-yl)ethenyl]-1-octyl-indol-1-ium

Systemtic Name: 1-methyl-3-[1-(1-methyl-1-octyl-indol-1-ium-3-yl)ethenyl]-1-octyl-indol-1-ium Openeye Name: 1-methyl-3-[1-(1-methyl-1-octyl-indol-1-ium-3-yl)vinyl]-1-octyl-indol-1-ium CAS Name: 1-methyl-3-[1-(1-methyl-1-octyl-3-indol-1-iumyl)ethenyl]-1-octylindol-1-ium IUPAC Name: 1-methyl-3-[1-(1-methyl-1-octylindol-1-ium-3-yl)ethenyl]-1-octylindol-1-ium Traditional Name: 1-methyl-3-[1-(1-methyl-1-octyl-indol-1-ium-3-yl)vinyl]-1-octyl-indol-1-ium Formula: C36H52N2+2 MolecularWeight: 512.81148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(C=C(C2=CC=CC=C21)C(=C)C3=C[N+](C4=CC=CC=C43)(C)CCCCCCCC)C

Isomeric SMILES

CCCCCCCC[N+]1(C=C(C2=CC=CC=C21)C(=C)C3=C[N+](C4=CC=CC=C43)(C)CCCCCCCC)C

InChI

InChI=1S/C36H52N2/c1-6-8-10-12-14-20-26-37(4)28-33(31-22-16-18-24-35(31)37)30(3)34-29-38(5,27-21-15-13-11-9-7-2)36-25-19-17-23-32(34)36/h16-19,22-25,28-29H,3,6-15,20-21,26-27H2,1-2,4-5H3/q+2