1-[2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoyl]imidazolidin-2-one

Systemtic Name: 1-[2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoyl]imidazolidin-2-one Openeye Name: 1-[2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]acetyl]imidazolidin-2-one CAS Name: 1-[1-oxo-2-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazin-1-iumyl]ethyl]-2-imidazolidinone IUPAC Name: 1-[2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]acetyl]imidazolidin-2-one Traditional Name: 1-[2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]acetyl]-2-imidazolidinone Formula: C16H20F3N4O4S+ MolecularWeight: 421.41461

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(C(=O)N1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H19F3N4O4S/c17-16(18,19)12-1-3-13(4-2-12)28(26,27)22-9-7-21(8-10-22)11-14(24)23-6-5-20-15(23)25/h1-4H,5-11H2,(H,20,25)/p+1