1-methyl-3-[20-(3-methylimidazol-3-ium-1-yl)icosyl]imidazol-1-ium

Systemtic Name: 1-methyl-3-[20-(3-methylimidazol-3-ium-1-yl)icosyl]imidazol-1-ium Openeye Name: 1-methyl-3-[20-(3-methylimidazol-3-ium-1-yl)icosyl]imidazol-1-ium CAS Name: 1-methyl-3-[20-(3-methyl-1-imidazol-3-iumyl)eicosyl]imidazol-1-ium IUPAC Name: 1-methyl-3-[20-(3-methylimidazol-3-ium-1-yl)icosyl]imidazol-1-ium Traditional Name: 1-methyl-3-[20-(3-methylimidazol-3-ium-1-yl)eicosyl]imidazol-1-ium Formula: C28H52N4+2 MolecularWeight: 444.73928

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCCCCCCCCCCCCCCCCCCCN2C=C[N+](=C2)C

Isomeric SMILES

C[N+]1=CN(C=C1)CCCCCCCCCCCCCCCCCCCCN2C=C[N+](=C2)C

InChI

InChI=1S/C28H52N4/c1-29-23-25-31(27-29)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-32-26-24-30(2)28-32/h23-28H,3-22H2,1-2H3/q+2