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

Systemtic Name: N-[(5S)-4-oxidanylidene-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Openeye Name: N-[(5S)-3-allyl-4-oxo-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide CAS Name: N-[(5S)-4-oxo-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide IUPAC Name: N-[(5S)-4-oxo-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Traditional Name: N-[(4S)-1-allyl-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]benzamide Formula: C20H17F3N3O2+ MolecularWeight: 388.36309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16F3N3O2/c1-2-13-26-16(14-9-5-3-6-10-14)24-19(18(26)28,20(21,22)23)25-17(27)15-11-7-4-8-12-15/h2-12H,1,13H2,(H,25,27)/p+1/t19-/m0/s1