(2R)-1-(4-fluoranylphenoxy)-3-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(4-fluoranylphenoxy)-3-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(4-fluorophenoxy)-3-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-fluorophenoxy)-3-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-fluorophenoxy)-3-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(4-fluorophenoxy)-3-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C23H26FN2O4S+ MolecularWeight: 445.526943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC=C(C=C2)F)O)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC=C(C=C2)F)O)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H25FN2O4S/c24-20-6-8-22(9-7-20)30-17-21(27)16-25-11-13-26(14-12-25)31(28,29)23-10-5-18-3-1-2-4-19(18)15-23/h1-10,15,21,27H,11-14,16-17H2/p+1/t21-/m1/s1