4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-methyl-benzoic acid

Systemtic Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-methyl-benzoic acid Openeye Name: 3-methyl-4-(quinuclidin-3-ylamino)benzoic acid CAS Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-methylbenzoic acid IUPAC Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-methylbenzoic acid Traditional Name: 3-methyl-4-(quinuclidin-3-ylamino)benzoic acid Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC2CN3CCC2CC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC2CN3CCC2CC3

InChI

InChI=1S/C15H20N2O2/c1-10-8-12(15(18)19)2-3-13(10)16-14-9-17-6-4-11(14)5-7-17/h2-3,8,11,14,16H,4-7,9H2,1H3,(H,18,19)