(E)-2-(4-chlorophenyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethenesulfonamide

Systemtic Name: (E)-2-(4-chlorophenyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethenesulfonamide Openeye Name: (E)-2-(4-chlorophenyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethenesulfonamide CAS Name: (E)-2-(4-chlorophenyl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]ethenesulfonamide IUPAC Name: (E)-2-(4-chlorophenyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethenesulfonamide Traditional Name: (E)-2-(4-chlorophenyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)ethenesulfonamide Formula: C15H22ClN2O2S+ MolecularWeight: 329.86538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNS(=O)(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CC[NH+](C1)CCCNS(=O)(=O)/C=C/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H21ClN2O2S/c16-15-6-4-14(5-7-15)8-13-21(19,20)17-9-3-12-18-10-1-2-11-18/h4-8,13,17H,1-3,9-12H2/p+1/b13-8+