3-[2-(4-pentylphenyl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 3-[2-(4-pentylphenyl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 3-[2-(4-pentylphenyl)ethynyl]quinuclidin-3-ol CAS Name: 3-[2-(4-pentylphenyl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 3-[2-(4-pentylphenyl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 3-[2-(4-amylphenyl)ethynyl]quinuclidin-3-ol Formula: C20H27NO MolecularWeight: 297.43448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2(CN3CCC2CC3)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2(CN3CCC2CC3)O

InChI

InChI=1S/C20H27NO/c1-2-3-4-5-17-6-8-18(9-7-17)10-13-20(22)16-21-14-11-19(20)12-15-21/h6-9,19,22H,2-5,11-12,14-16H2,1H3