1-methyl-1-[6-[4-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]phenyl]hexyl]piperidin-1-ium

Systemtic Name: 1-methyl-1-[6-[4-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]phenyl]hexyl]piperidin-1-ium Openeye Name: 1-methyl-1-[6-[4-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]phenyl]hexyl]piperidin-1-ium CAS Name: 1-methyl-1-[6-[4-[6-(1-methyl-1-piperidin-1-iumyl)hexyl]phenyl]hexyl]piperidin-1-ium IUPAC Name: 1-methyl-1-[6-[4-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]phenyl]hexyl]piperidin-1-ium Traditional Name: 1-methyl-1-[6-[4-[6-(1-methylpiperidin-1-ium-1-yl)hexyl]phenyl]hexyl]piperidin-1-ium Formula: C30H54N2+2 MolecularWeight: 442.76316

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCCCCCC2=CC=C(C=C2)CCCCCC[N+]3(CCCCC3)C

Isomeric SMILES

C[N+]1(CCCCC1)CCCCCCC2=CC=C(C=C2)CCCCCC[N+]3(CCCCC3)C

InChI

InChI=1S/C30H54N2/c1-31(25-13-7-14-26-31)23-11-5-3-9-17-29-19-21-30(22-20-29)18-10-4-6-12-24-32(2)27-15-8-16-28-32/h19-22H,3-18,23-28H2,1-2H3/q+2