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

Systemtic Name: 4-methoxy-N-[(5R)-4-oxidanylidene-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Openeye Name: N-[(5R)-3-allyl-4-oxo-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]-4-methoxy-benzamide CAS Name: 4-methoxy-N-[(5R)-4-oxo-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide IUPAC Name: 4-methoxy-N-[(5R)-4-oxo-2-phenyl-3-prop-2-enyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Traditional Name: N-[(4R)-1-allyl-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]-4-methoxy-benzamide Formula: C21H19F3N3O3+ MolecularWeight: 418.38907

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2(C(=O)[N+](=C(N2)C3=CC=CC=C3)CC=C)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N[C@]2(C(=O)[N+](=C(N2)C3=CC=CC=C3)CC=C)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3/c1-3-13-27-17(14-7-5-4-6-8-14)25-20(19(27)29,21(22,23)24)26-18(28)15-9-11-16(30-2)12-10-15/h3-12H,1,13H2,2H3,(H,26,28)/p+1/t20-/m1/s1