4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-bromanyl-benzenesulfonamide

Systemtic Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-bromanyl-benzenesulfonamide Openeye Name: 3-bromo-4-(quinuclidin-3-ylamino)benzenesulfonamide CAS Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-bromobenzenesulfonamide IUPAC Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-bromobenzenesulfonamide Traditional Name: 3-bromo-4-(quinuclidin-3-ylamino)benzenesulfonamide Formula: C13H18BrN3O2S MolecularWeight: 360.26992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)S(=O)(=O)N)Br

Isomeric SMILES

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)S(=O)(=O)N)Br

InChI

InChI=1S/C13H18BrN3O2S/c14-11-7-10(20(15,18)19)1-2-12(11)16-13-8-17-5-3-9(13)4-6-17/h1-2,7,9,13,16H,3-6,8H2,(H2,15,18,19)