methylazanium; 4-octadecyl-1-azabicyclo[2.2.2]octane; chloride

Systemtic Name: methylazanium; 4-octadecyl-1-azabicyclo[2.2.2]octane; chloride Openeye Name: methylammonium; 4-octadecylquinuclidine; chloride CAS Name: methylammonium; 4-octadecyl-1-azabicyclo[2.2.2]octane; chloride IUPAC Name: methylazanium; 4-octadecyl-1-azabicyclo[2.2.2]octane; chloride Traditional Name: methylammonium; 4-stearylquinuclidine; chloride Formula: C26H55ClN2 MolecularWeight: 431.1813

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC12CCN(CC1)CC2.C[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC12CCN(CC1)CC2.C[NH3+].[Cl-]

InChI

InChI=1S/C25H49N.CH5N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-19-22-26(23-20-25)24-21-25;1-2;/h2-24H2,1H3;2H2,1H3;1H