1-(3-nitrophenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Openeye Name: 1-(3-nitrophenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone CAS Name: 1-(3-nitrophenyl)-2-[2-(trifluoromethyl)-2-imidazolidine-1,3-diiumyl]ethanone IUPAC Name: 1-(3-nitrophenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Traditional Name: 1-(3-nitrophenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Formula: C12H14F3N3O3+2 MolecularWeight: 305.25307

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C([NH2+]1)(CC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1C[NH2+]C([NH2+]1)(CC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H12F3N3O3/c13-12(14,15)11(16-4-5-17-11)7-10(19)8-2-1-3-9(6-8)18(20)21/h1-3,6,16-17H,4-5,7H2/p+2