(2R)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: (2R)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: (2R)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: (2R)-2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: (2R)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: (2R)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-2-phenyl-1-pyrrolidino-ethanone Formula: C22H27FN3O3S+ MolecularWeight: 432.531483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C22H26FN3O3S/c23-19-9-6-10-20(17-19)30(28,29)26-15-13-24(14-16-26)21(18-7-2-1-3-8-18)22(27)25-11-4-5-12-25/h1-3,6-10,17,21H,4-5,11-16H2/p+1/t21-/m1/s1