4-fluoranyl-N-[2-oxidanylidene-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethoxy]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[2-oxidanylidene-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethoxy]benzenesulfonamide Openeye Name: 4-fluoro-N-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethoxy]benzenesulfonamide CAS Name: 4-fluoro-N-[2-oxo-2-[4-(4-pyridin-1-iumyl)-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-fluoro-N-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethoxy]benzenesulfonamide Traditional Name: 4-fluoro-N-[2-keto-2-(4-pyridin-1-ium-4-ylpiperazino)ethoxy]benzenesulfonamide Formula: C17H20FN4O4S+ MolecularWeight: 395.428503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CONS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CONS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O4S/c18-14-1-3-16(4-2-14)27(24,25)20-26-13-17(23)22-11-9-21(10-12-22)15-5-7-19-8-6-15/h1-8,20H,9-13H2/p+1