N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzenesulfonamide

Systemtic Name: N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzenesulfonamide Openeye Name: N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzenesulfonamide CAS Name: N-[(1S)-1-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-ylethyl]benzenesulfonamide Traditional Name: N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzenesulfonamide Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)C[C@H](C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O2S/c21-23(22,17-11-5-2-6-12-17)19-18(15-20-13-7-8-14-20)16-9-3-1-4-10-16/h1-6,9-12,18-19H,7-8,13-15H2/p+1/t18-/m1/s1