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

Systemtic Name: 4-hexadecyl-1-azabicyclo[2.2.2]octane; methylazanium; chloride Openeye Name: 4-hexadecylquinuclidine; methylammonium; chloride CAS Name: 4-hexadecyl-1-azabicyclo[2.2.2]octane; methylammonium; chloride IUPAC Name: 4-hexadecyl-1-azabicyclo[2.2.2]octane; methylazanium; chloride Traditional Name: 4-cetylquinuclidine; methylammonium; chloride Formula: C24H51ClN2 MolecularWeight: 403.12814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC12CCN(CC1)CC2.C[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC12CCN(CC1)CC2.C[NH3+].[Cl-]

InChI

InChI=1S/C23H45N.CH5N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-17-20-24(21-18-23)22-19-23;1-2;/h2-22H2,1H3;2H2,1H3;1H