N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide

Systemtic Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Openeye Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide CAS Name: N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Traditional Name: N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]benzenesulfonamide Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O2S/c20-22(21,15-6-2-1-3-7-15)18-13-14-8-9-16(17-12-14)19-10-4-5-11-19/h1-3,6-9,12,18H,4-5,10-11,13H2/p+1