[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Openeye Name: [1-(2-fluorophenyl)sulfonyl-4-piperidyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone CAS Name: [1-(2-fluorophenyl)sulfonyl-4-piperidinyl]-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]methanone IUPAC Name: [1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]methanone Traditional Name: [1-(2-fluorophenyl)sulfonyl-4-piperidyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Formula: C23H29FN3O3S+ MolecularWeight: 446.558063

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H28FN3O3S/c1-25-15-16-27(21(17-25)18-7-3-2-4-8-18)23(28)19-11-13-26(14-12-19)31(29,30)22-10-6-5-9-20(22)24/h2-10,19,21H,11-17H2,1H3/p+1/t21-/m0/s1