(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol dihydrate hydrobromide

Systemtic Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol dihydrate hydrobromide Openeye Name: (5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methanol dihydrate hydrobromide CAS Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methanol dihydrate hydrobromide IUPAC Name: (5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol dihydrate hydrobromide Traditional Name: (5-ethylquinuclidin-2-yl)-(6-methoxy-4-quinolyl)methanol dihydrate hydrobromide Formula: C20H31BrN2O4 MolecularWeight: 443.37514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)O.O.O.Br

Isomeric SMILES

CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)O.O.O.Br

InChI

InChI=1S/C20H26N2O2.BrH.2H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;;/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3;1H;2*1H2