N-[4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chloranyl-phenyl]methanesulfonamide

Systemtic Name: N-[4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chloranyl-phenyl]methanesulfonamide Openeye Name: N-[2-chloro-4-(quinuclidin-3-ylamino)phenyl]methanesulfonamide CAS Name: N-[4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chlorophenyl]methanesulfonamide IUPAC Name: N-[4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chlorophenyl]methanesulfonamide Traditional Name: N-[2-chloro-4-(quinuclidin-3-ylamino)phenyl]methanesulfonamide Formula: C14H20ClN3O2S MolecularWeight: 329.8455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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