3,4-bis(fluoranyl)-N-[(2R)-2-(4-phenylpiperazin-1-ium-1-yl)propyl]benzenesulfonamide

Systemtic Name: 3,4-bis(fluoranyl)-N-[(2R)-2-(4-phenylpiperazin-1-ium-1-yl)propyl]benzenesulfonamide Openeye Name: 3,4-difluoro-N-[(2R)-2-(4-phenylpiperazin-1-ium-1-yl)propyl]benzenesulfonamide CAS Name: 3,4-difluoro-N-[(2R)-2-(4-phenyl-1-piperazin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 3,4-difluoro-N-[(2R)-2-(4-phenylpiperazin-1-ium-1-yl)propyl]benzenesulfonamide Traditional Name: 3,4-difluoro-N-[(2R)-2-(4-phenylpiperazin-1-ium-1-yl)propyl]benzenesulfonamide Formula: C19H24F2N3O2S+ MolecularWeight: 396.474566

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC(=C(C=C1)F)F)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNS(=O)(=O)C1=CC(=C(C=C1)F)F)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H23F2N3O2S/c1-15(14-22-27(25,26)17-7-8-18(20)19(21)13-17)23-9-11-24(12-10-23)16-5-3-2-4-6-16/h2-8,13,15,22H,9-12,14H2,1H3/p+1/t15-/m1/s1