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

Systemtic Name: (1-hexyl-1-azoniabicyclo[2.2.2]octan-4-yl)-diphenyl-methanol Openeye Name: (1-hexylquinuclidin-1-ium-4-yl)-diphenyl-methanol CAS Name: (1-hexyl-1-azoniabicyclo[2.2.2]octan-4-yl)-diphenylmethanol IUPAC Name: (1-hexyl-1-azoniabicyclo[2.2.2]octan-4-yl)-diphenylmethanol Traditional Name: (1-hexylquinuclidin-1-ium-4-yl)-diphenyl-methanol Formula: C26H36NO+ MolecularWeight: 378.57014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]12CCC(CC1)(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CCCCCC[N+]12CCC(CC1)(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C26H36NO/c1-2-3-4-11-19-27-20-16-25(17-21-27,18-22-27)26(28,23-12-7-5-8-13-23)24-14-9-6-10-15-24/h5-10,12-15,28H,2-4,11,16-22H2,1H3/q+1