2-fluoranyl-N-[3-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-[3-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide Openeye Name: 2-fluoro-N-[3-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide CAS Name: 2-fluoro-N-[3-[(2S)-4-methyl-2-phenyl-1-piperazine-1,4-diiumyl]propyl]benzenesulfonamide IUPAC Name: 2-fluoro-N-[3-[(2S)-4-methyl-2-phenylpiperazine-1,4-diium-1-yl]propyl]benzenesulfonamide Traditional Name: 2-fluoro-N-[3-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]propyl]benzenesulfonamide Formula: C20H28FN3O2S+2 MolecularWeight: 393.518623

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](C(C1)C2=CC=CC=C2)CCCNS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C[NH+]1CC[NH+]([C@H](C1)C2=CC=CC=C2)CCCNS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H26FN3O2S/c1-23-14-15-24(19(16-23)17-8-3-2-4-9-17)13-7-12-22-27(25,26)20-11-6-5-10-18(20)21/h2-6,8-11,19,22H,7,12-16H2,1H3/p+2/t19-/m1/s1