2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-nitro-4-(trifluoromethyl)anilino]-2-oxo-acetic acid CAS Name: 2-[2-nitro-4-(trifluoromethyl)anilino]-2-oxoacetic acid IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)anilino]-2-oxoacetic acid Traditional Name: 2-keto-2-[2-nitro-4-(trifluoromethyl)anilino]acetic acid Formula: C9H5F3N2O5 MolecularWeight: 278.14161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=O)C(=O)O

InChI

InChI=1S/C9H5F3N2O5/c10-9(11,12)4-1-2-5(6(3-4)14(18)19)13-7(15)8(16)17/h1-3H,(H,13,15)(H,16,17)