1-azoniabicyclo[2.2.2]octan-3-yl-(4-chlorophenyl)-phenyl-methanol chloride

Systemtic Name: 1-azoniabicyclo[2.2.2]octan-3-yl-(4-chlorophenyl)-phenyl-methanol chloride Openeye Name: (4-chlorophenyl)-phenyl-quinuclidin-1-ium-3-yl-methanol chloride CAS Name: 1-azoniabicyclo[2.2.2]octan-3-yl-(4-chlorophenyl)-phenylmethanol chloride IUPAC Name: 1-azoniabicyclo[2.2.2]octan-3-yl-(4-chlorophenyl)-phenylmethanol chloride Traditional Name: (4-chlorophenyl)-phenyl-quinuclidin-1-ium-3-yl-methanol chloride Formula: C20H23Cl2NO MolecularWeight: 364.30872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO.ClH/c21-18-8-6-17(7-9-18)20(23,16-4-2-1-3-5-16)19-14-22-12-10-15(19)11-13-22;/h1-9,15,19,23H,10-14H2;1H