[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenyl-methanol bromide

Systemtic Name: [1-(3-methoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenyl-methanol bromide Openeye Name: [1-(3-methoxypropyl)quinuclidin-1-ium-4-yl]-diphenyl-methanol bromide CAS Name: [1-(3-methoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenylmethanol bromide IUPAC Name: [1-(3-methoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenylmethanol bromide Traditional Name: [1-(3-methoxypropyl)quinuclidin-1-ium-4-yl]-diphenyl-methanol bromide Formula: C24H32BrNO2 MolecularWeight: 446.42038

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[N+]12CCC(CC1)(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Br-]

Isomeric SMILES

COCCC[N+]12CCC(CC1)(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Br-]

InChI

InChI=1S/C24H32NO2.BrH/c1-27-20-8-16-25-17-13-23(14-18-25,15-19-25)24(26,21-9-4-2-5-10-21)22-11-6-3-7-12-22;/h2-7,9-12,26H,8,13-20H2,1H3;1H/q+1;/p-1