[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 2-methylpropane-2-sulfonate

Systemtic Name: [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 2-methylpropane-2-sulfonate Openeye Name: [(6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methyl] 2-methylpropane-2-sulfonate CAS Name: 2-methyl-2-propanesulfonic acid IUPAC Name: [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] 2-methylpropane-2-sulfonate Traditional Name: 2-methylpropane-2-sulfonic acid [(6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methyl] ester Formula: C24H32N2O4S MolecularWeight: 444.58688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)OC(C1CC2CCN1CC2C=C)C3=C4C=C(C=CC4=NC=C3)OC

Isomeric SMILES

CC(C)(C)S(=O)(=O)OC(C1CC2CCN1CC2C=C)C3=C4C=C(C=CC4=NC=C3)OC

InChI

InChI=1S/C24H32N2O4S/c1-6-16-15-26-12-10-17(16)13-22(26)23(30-31(27,28)24(2,3)4)19-9-11-25-21-8-7-18(29-5)14-20(19)21/h6-9,11,14,16-17,22-23H,1,10,12-13,15H2,2-5H3