[1-[(4-methylphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenyl-methanol

Systemtic Name: [1-[(4-methylphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenyl-methanol Openeye Name: diphenyl-[1-(p-tolylmethyl)quinuclidin-1-ium-4-yl]methanol CAS Name: [1-[(4-methylphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenylmethanol IUPAC Name: [1-[(4-methylphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-4-yl]-diphenylmethanol Traditional Name: [1-(4-methylbenzyl)quinuclidin-1-ium-4-yl]-diphenyl-methanol Formula: C28H32NO+ MolecularWeight: 398.55978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]23CCC(CC2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]23CCC(CC2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C28H32NO/c1-23-12-14-24(15-13-23)22-29-19-16-27(17-20-29,18-21-29)28(30,25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-15,30H,16-22H2,1H3/q+1