N1-(1-azabicyclo[2.2.2]octan-3-yl)-N4,N4-diethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-(1-azabicyclo[2.2.2]octan-3-yl)-N4,N4-diethyl-benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-quinuclidin-3-yl-benzene-1,4-disulfonamide CAS Name: N1-(1-azabicyclo[2.2.2]octan-3-yl)-N4,N4-diethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-(1-azabicyclo[2.2.2]octan-3-yl)-4-N,4-N-diethylbenzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-quinuclidin-3-yl-benzene-1,4-disulfonamide Formula: C17H27N3O4S2 MolecularWeight: 401.54398

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2CN3CCC2CC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2CN3CCC2CC3

InChI

InChI=1S/C17H27N3O4S2/c1-3-20(4-2)26(23,24)16-7-5-15(6-8-16)25(21,22)18-17-13-19-11-9-14(17)10-12-19/h5-8,14,17-18H,3-4,9-13H2,1-2H3