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

Systemtic Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] 2-cyclohexyl-2-phenyl-ethanoate Openeye Name: [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] 2-cyclohexyl-2-phenyl-acetate CAS Name: 2-cyclohexyl-2-phenylacetic 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-cyclohexyl-2-phenylacetate Traditional Name: 2-cyclohexyl-2-phenyl-acetic acid [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] ester Formula: C33H40N2O2 MolecularWeight: 496.6829

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C(C5CCCCC5)C6=CC=CC=C6

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C(C5CCCCC5)C6=CC=CC=C6

InChI

InChI=1S/C33H40N2O2/c1-2-23-22-35-20-18-26(23)21-30(35)32(28-17-19-34-29-16-10-9-15-27(28)29)37-33(36)31(24-11-5-3-6-12-24)25-13-7-4-8-14-25/h3,5-6,9-12,15-17,19,23,25-26,30-32H,2,4,7-8,13-14,18,20-22H2,1H3