4-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium-1-yl]carbonyl-1,3-dihydroimidazol-2-one

Systemtic Name: 4-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium-1-yl]carbonyl-1,3-dihydroimidazol-2-one Openeye Name: 4-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium-1-carbonyl]-1,3-dihydroimidazol-2-one CAS Name: 4-[oxo-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazin-4-iumyl]methyl]-1,3-dihydroimidazol-2-one IUPAC Name: 4-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-4-ium-1-carbonyl]-1,3-dihydroimidazol-2-one Traditional Name: 4-[4-[3-(trifluoromethyl)benzyl]piperazin-4-ium-1-carbonyl]-4-imidazolin-2-one Formula: C16H18F3N4O2+ MolecularWeight: 355.33493

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=CNC(=O)N3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)C(F)(F)F)C(=O)C3=CNC(=O)N3

InChI

InChI=1S/C16H17F3N4O2/c17-16(18,19)12-3-1-2-11(8-12)10-22-4-6-23(7-5-22)14(24)13-9-20-15(25)21-13/h1-3,8-9H,4-7,10H2,(H2,20,21,25)/p+1