N-[(5R)-4-oxidanylidene-2-phenyl-3-(phenylmethyl)-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]butanamide

Systemtic Name: N-[(5R)-4-oxidanylidene-2-phenyl-3-(phenylmethyl)-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]butanamide Openeye Name: N-[(5R)-3-benzyl-4-oxo-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]butanamide CAS Name: N-[(5R)-4-oxo-2-phenyl-3-(phenylmethyl)-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]butanamide IUPAC Name: N-[(5R)-3-benzyl-4-oxo-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]butanamide Traditional Name: N-[(4R)-1-benzyl-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]butyramide Formula: C21H21F3N3O2+ MolecularWeight: 404.40555

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1(C(=O)[N+](=C(N1)C2=CC=CC=C2)CC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCCC(=O)N[C@]1(C(=O)[N+](=C(N1)C2=CC=CC=C2)CC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O2/c1-2-9-17(28)25-20(21(22,23)24)19(29)27(14-15-10-5-3-6-11-15)18(26-20)16-12-7-4-8-13-16/h3-8,10-13H,2,9,14H2,1H3,(H,25,28)/p+1/t20-/m0/s1