4-bromanyl-N-[(2R,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(2R,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[(2R,3R)-2-(3-pyridylmethyl)quinuclidin-3-yl]benzenesulfonamide CAS Name: 4-bromo-N-[(2R,3R)-2-(3-pyridinylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzenesulfonamide IUPAC Name: 4-bromo-N-[(2R,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[(2R,3R)-2-(3-pyridylmethyl)quinuclidin-3-yl]benzenesulfonamide Formula: C19H22BrN3O2S MolecularWeight: 436.36588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2CC3=CN=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN2CCC1[C@H]([C@H]2CC3=CN=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H22BrN3O2S/c20-16-3-5-17(6-4-16)26(24,25)22-19-15-7-10-23(11-8-15)18(19)12-14-2-1-9-21-13-14/h1-6,9,13,15,18-19,22H,7-8,10-12H2/t18-,19-/m1/s1