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

Systemtic Name: N-[(5S)-4-oxidanylidene-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]ethanamide Openeye Name: N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]acetamide CAS Name: N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]acetamide IUPAC Name: N-[(5S)-4-oxo-2-phenyl-3-propyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]acetamide Traditional Name: N-[(4S)-5-keto-2-phenyl-1-propyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]acetamide Formula: C15H17F3N3O2+ MolecularWeight: 328.30959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16F3N3O2/c1-3-9-21-12(11-7-5-4-6-8-11)20-14(13(21)23,15(16,17)18)19-10(2)22/h4-8H,3,9H2,1-2H3,(H,19,22)/p+1/t14-/m1/s1