3-[(2-methylphenyl)methyl]-1-azabicyclo[2.2.2]octane-4-carboxylic acid

Systemtic Name: 3-[(2-methylphenyl)methyl]-1-azabicyclo[2.2.2]octane-4-carboxylic acid Openeye Name: 3-(o-tolylmethyl)quinuclidine-4-carboxylic acid CAS Name: 3-[(2-methylphenyl)methyl]-1-azabicyclo[2.2.2]octane-4-carboxylic acid IUPAC Name: 3-[(2-methylphenyl)methyl]-1-azabicyclo[2.2.2]octane-4-carboxylic acid Traditional Name: 3-(2-methylbenzyl)quinuclidine-4-carboxylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2CN3CCC2(CC3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CC2CN3CCC2(CC3)C(=O)O

InChI

InChI=1S/C16H21NO2/c1-12-4-2-3-5-13(12)10-14-11-17-8-6-16(14,7-9-17)15(18)19/h2-5,14H,6-11H2,1H3,(H,18,19)