2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethyl)acetamide Formula: C18H21F3N3O3S+ MolecularWeight: 416.43785

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC(F)(F)F)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC(F)(F)F)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H20F3N3O3S/c19-18(20,21)13-22-17(25)12-23-7-9-24(10-8-23)28(26,27)16-6-5-14-3-1-2-4-15(14)11-16/h1-6,11H,7-10,12-13H2,(H,22,25)/p+1