5-[(5-bromanylfuran-2-yl)methylamino]-2,4-bis(fluoranyl)benzoic acid

Systemtic Name: 5-[(5-bromanylfuran-2-yl)methylamino]-2,4-bis(fluoranyl)benzoic acid Openeye Name: 5-[(5-bromo-2-furyl)methylamino]-2,4-difluoro-benzoic acid CAS Name: 5-[(5-bromo-2-furanyl)methylamino]-2,4-difluorobenzoic acid IUPAC Name: 5-[(5-bromofuran-2-yl)methylamino]-2,4-difluorobenzoic acid Traditional Name: 5-[(5-bromo-2-furyl)methylamino]-2,4-difluoro-benzoic acid Formula: C12H8BrF2NO3 MolecularWeight: 332.097626

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)CNC2=C(C=C(C(=C2)C(=O)O)F)F

Isomeric SMILES

C1=C(OC(=C1)Br)CNC2=C(C=C(C(=C2)C(=O)O)F)F

InChI

InChI=1S/C12H8BrF2NO3/c13-11-2-1-6(19-11)5-16-10-3-7(12(17)18)8(14)4-9(10)15/h1-4,16H,5H2,(H,17,18)