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

Systemtic Name: (5S)-3-cyclopentyl-5-[(4-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one Openeye Name: (5S)-3-cyclopentyl-5-[(4-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one CAS Name: (5S)-3-cyclopentyl-5-[(4-methyl-2-pyridin-1-iumyl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one IUPAC Name: (5S)-3-cyclopentyl-5-[(4-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-4-one Traditional Name: (5S)-3-cyclopentyl-5-[(4-methylpyridin-1-ium-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-2-imidazolin-3-ium-4-one Formula: C21H23F3N4O+2 MolecularWeight: 404.42873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC2(C(=O)[N+](=C(N2)C3=CC=CC=C3)C4CCCC4)C(F)(F)F

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@]2(C(=O)[N+](=C(N2)C3=CC=CC=C3)C4CCCC4)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O/c1-14-11-12-25-17(13-14)26-20(21(22,23)24)19(29)28(16-9-5-6-10-16)18(27-20)15-7-3-2-4-8-15/h2-4,7-8,11-13,16H,5-6,9-10H2,1H3,(H,25,26)/p+2/t20-/m0/s1