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

Systemtic Name: 3-chloranyl-N-[(5S)-4-oxidanylidene-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Openeye Name: 3-chloro-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide CAS Name: 3-chloro-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide IUPAC Name: 3-chloro-N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Traditional Name: 3-chloro-N-[(4S)-5-keto-2-phenyl-1-propyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]benzamide Formula: C20H18ClF3N3O2+ MolecularWeight: 424.82403

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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(=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClF3N3O2/c1-2-11-27-16(13-7-4-3-5-8-13)25-19(18(27)29,20(22,23)24)26-17(28)14-9-6-10-15(21)12-14/h3-10,12H,2,11H2,1H3,(H,26,28)/p+1/t19-/m0/s1