[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] 2-chloranylbenzoate

Systemtic Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] 2-chloranylbenzoate Openeye Name: [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(4-quinolinyl)methyl] ester IUPAC Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] ester Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H27ClN2O2/c1-2-17-16-29-14-12-18(17)15-24(29)25(31-26(30)21-8-3-5-9-22(21)27)20-11-13-28-23-10-6-4-7-19(20)23/h3-11,13,17-18,24-25H,2,12,14-16H2,1H3