[(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] 9H-xanthene-9-carboxylate

Systemtic Name: [(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methyl] 9H-xanthene-9-carboxylate Openeye Name: [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic 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] 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid [(5-ethylquinuclidin-2-yl)-(4-quinolyl)methyl] ester Formula: C33H32N2O3 MolecularWeight: 504.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C5C6=CC=CC=C6OC7=CC=CC=C57

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OC(=O)C5C6=CC=CC=C6OC7=CC=CC=C57

InChI

InChI=1S/C33H32N2O3/c1-2-21-20-35-18-16-22(21)19-28(35)32(24-15-17-34-27-12-6-3-9-23(24)27)38-33(36)31-25-10-4-7-13-29(25)37-30-14-8-5-11-26(30)31/h3-15,17,21-22,28,31-32H,2,16,18-20H2,1H3