tris[3-[[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]amino]propyl]-methyl-azanium

Systemtic Name: tris[3-[[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]amino]propyl]-methyl-azanium Openeye Name: tris[3-[4-(1,3-dimethylimidazol-1-ium-2-yl)azoanilino]propyl]-methyl-ammonium CAS Name: tris[3-[4-[(1,3-dimethyl-2-imidazol-1-iumyl)azo]anilino]propyl]-methylammonium IUPAC Name: tris[3-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]anilino]propyl]-methylazanium Traditional Name: tris[3-[4-(1,3-dimethylimidazol-1-ium-2-yl)azoanilino]propyl]-methyl-ammonium Formula: C43H60N16+4 MolecularWeight: 801.0437

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NCCC[N+](C)(CCCNC3=CC=C(C=C3)N=NC4=[N+](C=CN4C)C)CCCNC5=CC=C(C=C5)N=NC6=[N+](C=CN6C)C)C

Isomeric SMILES

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NCCC[N+](C)(CCCNC3=CC=C(C=C3)N=NC4=[N+](C=CN4C)C)CCCNC5=CC=C(C=C5)N=NC6=[N+](C=CN6C)C)C

InChI

InChI=1S/C43H57N16/c1-53-26-27-54(2)41(53)50-47-38-17-11-35(12-18-38)44-23-8-32-59(7,33-9-24-45-36-13-19-39(20-14-36)48-51-42-55(3)28-29-56(42)4)34-10-25-46-37-15-21-40(22-16-37)49-52-43-57(5)30-31-58(43)6/h11-22,26-31H,8-10,23-25,32-34H2,1-7H3/q+1/p+3