(2R)-4-methyl-2-phenyl-1-[4-(trifluoromethyloxy)phenyl]sulfonyl-piperazin-4-ium

Systemtic Name: (2R)-4-methyl-2-phenyl-1-[4-(trifluoromethyloxy)phenyl]sulfonyl-piperazin-4-ium Openeye Name: (2R)-4-methyl-2-phenyl-1-[4-(trifluoromethoxy)phenyl]sulfonyl-piperazin-4-ium CAS Name: (2R)-4-methyl-2-phenyl-1-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-4-ium IUPAC Name: (2R)-4-methyl-2-phenyl-1-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-4-ium Traditional Name: (2R)-4-methyl-2-phenyl-1-[4-(trifluoromethoxy)phenyl]sulfonyl-piperazin-4-ium Formula: C18H20F3N2O3S+ MolecularWeight: 401.42321

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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)OC(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C18H19F3N2O3S/c1-22-11-12-23(17(13-22)14-5-3-2-4-6-14)27(24,25)16-9-7-15(8-10-16)26-18(19,20)21/h2-10,17H,11-13H2,1H3/p+1/t17-/m0/s1