(1S,2S,3S,5S)-1,5-dimethyl-1-oxidanidyl-2-phenyl-3-(phenylsulfinyl)pyrrolidin-1-ium

Systemtic Name: (1S,2S,3S,5S)-1,5-dimethyl-1-oxidanidyl-2-phenyl-3-(phenylsulfinyl)pyrrolidin-1-ium Openeye Name: (1S,2S,3S,5S)-3-(benzenesulfinyl)-1,5-dimethyl-1-oxido-2-phenyl-pyrrolidin-1-ium CAS Name: (1S,2S,3S,5S)-3-(benzenesulfinyl)-1,5-dimethyl-1-oxido-2-phenylpyrrolidin-1-ium IUPAC Name: (1S,2S,3S,5S)-3-(benzenesulfinyl)-1,5-dimethyl-1-oxido-2-phenylpyrrolidin-1-ium Traditional Name: (1S,2S,3S,5S)-3-(benzenesulfinyl)-1,5-dimethyl-1-oxido-2-phenyl-pyrrolidin-1-ium Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C([N+]1(C)[O-])C2=CC=CC=C2)S(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1C[C@@H]([C@@H]([N@@+]1(C)[O-])C2=CC=CC=C2)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21NO2S/c1-14-13-17(22(21)16-11-7-4-8-12-16)18(19(14,2)20)15-9-5-3-6-10-15/h3-12,14,17-18H,13H2,1-2H3/t14-,17-,18-,19-,22?/m0/s1