(2R)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium

Systemtic Name: (2R)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium Openeye Name: (2R)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium CAS Name: (2R)-1-(3-chloro-4-fluorophenyl)sulfonyl-4-methyl-2-phenylpiperazin-4-ium IUPAC Name: (2R)-1-(3-chloro-4-fluorophenyl)sulfonyl-4-methyl-2-phenylpiperazin-4-ium Traditional Name: (2R)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazin-4-ium Formula: C17H19ClFN2O2S+ MolecularWeight: 369.861363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H18ClFN2O2S/c1-20-9-10-21(17(12-20)13-5-3-2-4-6-13)24(22,23)14-7-8-16(19)15(18)11-14/h2-8,11,17H,9-10,12H2,1H3/p+1/t17-/m0/s1