3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzoate

Systemtic Name: 3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzoate Openeye Name: 3,4-difluoro-2-(2-fluoro-4-iodo-anilino)benzoate CAS Name: 3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzoate IUPAC Name: 3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzoate Traditional Name: 3,4-difluoro-2-(2-fluoro-4-iodo-anilino)benzoate Formula: C13H6F3INO2- MolecularWeight: 392.09192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)F)NC2=C(C=CC(=C2F)F)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1I)F)NC2=C(C=CC(=C2F)F)C(=O)[O-]

InChI

InChI=1S/C13H7F3INO2/c14-8-3-2-7(13(19)20)12(11(8)16)18-10-4-1-6(17)5-9(10)15/h1-5,18H,(H,19,20)/p-1