4-iodanyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzenesulfonamide

Systemtic Name: 4-iodanyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzenesulfonamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-4-iodo-benzenesulfonamide CAS Name: 4-iodo-N-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzenesulfonamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-4-iodobenzenesulfonamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-4-iodo-benzenesulfonamide Formula: C17H20IN2O2S+ MolecularWeight: 443.32237

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NS(=O)(=O)C2=CC=C(C=C2)I)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@@H]1NS(=O)(=O)C2=CC=C(C=C2)I)CC3=CC=CC=C3

InChI

InChI=1S/C17H19IN2O2S/c18-15-6-8-17(9-7-15)23(21,22)19-16-10-11-20(13-16)12-14-4-2-1-3-5-14/h1-9,16,19H,10-13H2/p+1/t16-/m1/s1