(1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol

Systemtic Name: (1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: (1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol CAS Name: (1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazin-1-iumyl]ethanol IUPAC Name: (1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol Traditional Name: (1R)-1-phenyl-2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanol Formula: C19H22F3N2O3S+ MolecularWeight: 415.44979

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(C2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1C[C@@H](C2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H21F3N2O3S/c20-19(21,22)16-8-4-5-9-18(16)28(26,27)24-12-10-23(11-13-24)14-17(25)15-6-2-1-3-7-15/h1-9,17,25H,10-14H2/p+1/t17-/m0/s1