(5S)-3-cyclohexyl-5-[(3-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one

Systemtic Name: (5S)-3-cyclohexyl-5-[(3-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one Openeye Name: (5S)-3-cyclohexyl-5-[(3-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one CAS Name: (5S)-3-cyclohexyl-5-[(3-methyl-2-pyridin-1-iumyl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one IUPAC Name: (5S)-3-cyclohexyl-5-[(3-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one Traditional Name: (5S)-3-cyclohexyl-5-[(3-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-2-imidazolin-3-ium-4-one Formula: C22H25F3N4O+2 MolecularWeight: 418.45531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=CC=C1)NC2(C(=O)[N+](=C(N2)C3=CC=CC=C3)C4CCCCC4)C(F)(F)F

Isomeric SMILES

CC1=C([NH+]=CC=C1)N[C@]2(C(=O)[N+](=C(N2)C3=CC=CC=C3)C4CCCCC4)C(F)(F)F

InChI

InChI=1S/C22H23F3N4O/c1-15-9-8-14-26-18(15)27-21(22(23,24)25)20(30)29(17-12-6-3-7-13-17)19(28-21)16-10-4-2-5-11-16/h2,4-5,8-11,14,17H,3,6-7,12-13H2,1H3,(H,26,27)/p+2/t21-/m0/s1