5-bromanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]benzoic acid Openeye Name: 5-bromo-2-[(2,2,2-trifluoroacetyl)amino]benzoic acid CAS Name: 5-bromo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid IUPAC Name: 5-bromo-2-[(2,2,2-trifluoroacetyl)amino]benzoic acid Traditional Name: 5-bromo-2-[(2,2,2-trifluoroacetyl)amino]benzoic acid Formula: C9H5BrF3NO3 MolecularWeight: 312.04011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)O)NC(=O)C(F)(F)F

InChI

InChI=1S/C9H5BrF3NO3/c10-4-1-2-6(5(3-4)7(15)16)14-8(17)9(11,12)13/h1-3H,(H,14,17)(H,15,16)