4-methyl-N-[(5S)-4-oxidanylidene-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide

Systemtic Name: 4-methyl-N-[(5S)-4-oxidanylidene-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Openeye Name: 4-methyl-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide CAS Name: 4-methyl-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide IUPAC Name: 4-methyl-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Traditional Name: N-[(4S)-5-keto-2-phenyl-1-propyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]-4-methyl-benzamide Formula: C21H21F3N3O2+ MolecularWeight: 404.40555

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(NC(C1=O)(C(F)(F)F)NC(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCC[N+]1=C(N[C@](C1=O)(C(F)(F)F)NC(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H20F3N3O2/c1-3-13-27-17(15-7-5-4-6-8-15)25-20(19(27)29,21(22,23)24)26-18(28)16-11-9-14(2)10-12-16/h4-12H,3,13H2,1-2H3,(H,26,28)/p+1/t20-/m0/s1