(1S)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol

Systemtic Name: (1S)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol Openeye Name: (1S)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol CAS Name: (1S)-2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-phenylethanol IUPAC Name: (1S)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenylethanol Traditional Name: (1S)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-phenyl-ethanol Formula: C18H22FN2O3S+ MolecularWeight: 365.442283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(C2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](C2=CC=CC=C2)O)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H21FN2O3S/c19-16-8-4-5-9-18(16)25(23,24)21-12-10-20(11-13-21)14-17(22)15-6-2-1-3-7-15/h1-9,17,22H,10-14H2/p+1/t17-/m1/s1