3,4-bis[2,2,2-tris(fluoranyl)ethanoylamino]benzoic acid

Systemtic Name: 3,4-bis[2,2,2-tris(fluoranyl)ethanoylamino]benzoic acid Openeye Name: 3,4-bis[(2,2,2-trifluoroacetyl)amino]benzoic acid CAS Name: 3,4-bis[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid IUPAC Name: 3,4-bis[(2,2,2-trifluoroacetyl)amino]benzoic acid Traditional Name: 3,4-bis[(2,2,2-trifluoroacetyl)amino]benzoic acid Formula: C11H6F6N2O4 MolecularWeight: 344.166759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)C(F)(F)F)NC(=O)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)C(F)(F)F)NC(=O)C(F)(F)F

InChI

InChI=1S/C11H6F6N2O4/c12-10(13,14)8(22)18-5-2-1-4(7(20)21)3-6(5)19-9(23)11(15,16)17/h1-3H,(H,18,22)(H,19,23)(H,20,21)