N-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-benzenesulfonamide

Systemtic Name: N-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-benzenesulfonamide Openeye Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-benzenesulfonamide CAS Name: N-[(2S)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propyl]-N-phenylbenzenesulfonamide IUPAC Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropyl]-N-phenylbenzenesulfonamide Traditional Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-benzenesulfonamide Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3S/c22-18(15-20-13-7-8-14-20)16-21(17-9-3-1-4-10-17)25(23,24)19-11-5-2-6-12-19/h1-6,9-12,18,22H,7-8,13-16H2/p+1/t18-/m0/s1