N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-propyl]benzenesulfonamide

Systemtic Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-propyl]benzenesulfonamide Openeye Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-propyl]benzenesulfonamide CAS Name: N-[(2R)-2-phenyl-2-(1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-ylpropyl]benzenesulfonamide Traditional Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-propyl]benzenesulfonamide Formula: C20H27N2O2S+ MolecularWeight: 359.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC=C1)(C2=CC=CC=C2)[NH+]3CCCCC3

Isomeric SMILES

C[C@](CNS(=O)(=O)C1=CC=CC=C1)(C2=CC=CC=C2)[NH+]3CCCCC3

InChI

InChI=1S/C20H26N2O2S/c1-20(18-11-5-2-6-12-18,22-15-9-4-10-16-22)17-21-25(23,24)19-13-7-3-8-14-19/h2-3,5-8,11-14,21H,4,9-10,15-17H2,1H3/p+1/t20-/m0/s1