[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 4-phenylbenzoate

Systemtic Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 4-phenylbenzoate Openeye Name: [(5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methyl] ester IUPAC Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [(5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methyl] ester Formula: C33H34N2O3 MolecularWeight: 506.63466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC(=O)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC(=O)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H34N2O3/c1-3-22-21-35-18-16-26(22)19-31(35)32(28-15-17-34-30-14-13-27(37-2)20-29(28)30)38-33(36)25-11-9-24(10-12-25)23-7-5-4-6-8-23/h4-15,17,20,22,26,31-32H,3,16,18-19,21H2,1-2H3