4-fluoranyl-N-[3-[4-[(2R)-2-pyridin-2-ylpiperidin-1-ium-1-yl]piperidin-1-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-[4-[(2R)-2-pyridin-2-ylpiperidin-1-ium-1-yl]piperidin-1-yl]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-[4-[(2R)-2-(2-pyridyl)piperidin-1-ium-1-yl]-1-piperidyl]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-[4-[(2R)-2-(2-pyridinyl)-1-piperidin-1-iumyl]-1-piperidinyl]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-[4-[(2R)-2-pyridin-2-ylpiperidin-1-ium-1-yl]piperidin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-[4-[(2R)-2-(2-pyridyl)piperidin-1-ium-1-yl]piperidino]phenyl]benzenesulfonamide Formula: C27H32FN4O2S+ MolecularWeight: 495.631983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C2=CC=CC=N2)C3CCN(CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC[NH+]([C@H](C1)C2=CC=CC=N2)C3CCN(CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H31FN4O2S/c28-21-10-12-25(13-11-21)35(33,34)30-22-6-5-7-24(20-22)31-18-14-23(15-19-31)32-17-4-2-9-27(32)26-8-1-3-16-29-26/h1,3,5-8,10-13,16,20,23,27,30H,2,4,9,14-15,17-19H2/p+1/t27-/m1/s1