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4-[2-(1-azabicyclo[2.2.2]octan-2-ylmethyl)phenyl]benzoic acid

4-[2-(1-azabicyclo[2.2.2]octan-2-ylmethyl)phenyl]benzoic acid

Systemtic Name:4-[2-(1-azabicyclo[2.2.2]octan-2-ylmethyl)phenyl]benzoic acid
Openeye Name:4-[2-(quinuclidin-2-ylmethyl)phenyl]benzoic acid
CAS Name:4-[2-(1-azabicyclo[2.2.2]octan-2-ylmethyl)phenyl]benzoic acid
IUPAC Name:4-[2-(1-azabicyclo[2.2.2]octan-2-ylmethyl)phenyl]benzoic acid
Traditional Name:4-[2-(quinuclidin-2-ylmethyl)phenyl]benzoic acid
Formula: C21H23NO2
MolecularWeight: 321.41282
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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1CC2CC3=CC=CC=C3C4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1CN2CCC1CC2CC3=CC=CC=C3C4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C21H23NO2/c23-21(24)17-7-5-16(6-8-17)20-4-2-1-3-18(20)14-19-13-15-9-11-22(19)12-10-15/h1-8,15,19H,9-14H2,(H,23,24)


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