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

Systemtic Name: [(4R)-5-oxidanylidene-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl] ethanoate Openeye Name: [(4R)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl] acetate CAS Name: acetic acid [(4R)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl] ester IUPAC Name: [(4R)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl] acetate Traditional Name: acetic acid [(4R)-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-3-ium-4-yl] ester Formula: C12H10F3N2O3+ MolecularWeight: 287.21461

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(=O)NC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CC(=O)O[C@]1(C(=O)NC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C12H9F3N2O3/c1-7(18)20-11(12(13,14)15)10(19)16-9(17-11)8-5-3-2-4-6-8/h2-6H,1H3,(H,16,17,19)/p+1/t11-/m1/s1