3-[4-[2,3,4-tris(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: 3-[4-[2,3,4-tris(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: 3-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: 3-[4-(2,3,4-trifluorophenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: 3-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: 3-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C13H17F3N3O3S+ MolecularWeight: 352.35259

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)N)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)N)S(=O)(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C13H16F3N3O3S/c14-9-1-2-10(13(16)12(9)15)23(21,22)19-7-5-18(6-8-19)4-3-11(17)20/h1-2H,3-8H2,(H2,17,20)/p+1