N-[3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-chloranyl-phenyl]methanesulfonamide

Systemtic Name: N-[3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-chloranyl-phenyl]methanesulfonamide Openeye Name: N-[4-chloro-3-(quinuclidin-3-ylamino)phenyl]methanesulfonamide CAS Name: N-[3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-chlorophenyl]methanesulfonamide IUPAC Name: N-[3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-chlorophenyl]methanesulfonamide Traditional Name: N-[4-chloro-3-(quinuclidin-3-ylamino)phenyl]methanesulfonamide Formula: C14H20ClN3O2S MolecularWeight: 329.8455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC2CN3CCC2CC3

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC2CN3CCC2CC3

InChI

InChI=1S/C14H20ClN3O2S/c1-21(19,20)17-11-2-3-12(15)13(8-11)16-14-9-18-6-4-10(14)5-7-18/h2-3,8,10,14,16-17H,4-7,9H2,1H3