3-(2,2-diphenylethenyl)-1-azoniabicyclo[2.2.2]octane chloride

Systemtic Name: 3-(2,2-diphenylethenyl)-1-azoniabicyclo[2.2.2]octane chloride Openeye Name: 3-(2,2-diphenylvinyl)quinuclidin-1-ium chloride CAS Name: 3-(2,2-diphenylethenyl)-1-azoniabicyclo[2.2.2]octane chloride IUPAC Name: 3-(2,2-diphenylethenyl)-1-azoniabicyclo[2.2.2]octane chloride Traditional Name: 3-(2,2-diphenylvinyl)quinuclidin-1-ium chloride Formula: C21H24ClN MolecularWeight: 325.87496

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)C=C(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1C[NH+]2CCC1C(C2)C=C(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H23N.ClH/c1-3-7-18(8-4-1)21(19-9-5-2-6-10-19)15-20-16-22-13-11-17(20)12-14-22;/h1-10,15,17,20H,11-14,16H2;1H