5-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-benzoic acid phosphate

Systemtic Name: 5-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-benzoic acid phosphate Openeye Name: 5-(2,4-difluorophenyl)-2-hydroxy-benzoic acid phosphate CAS Name: 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid phosphate IUPAC Name: 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid phosphate Traditional Name: 5-(2,4-difluorophenyl)-2-hydroxy-benzoic acid phosphate Formula: C13H8F2O7P-3 MolecularWeight: 345.168987

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C13H8F2O3.H3O4P/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18;1-5(2,3)4/h1-6,16H,(H,17,18);(H3,1,2,3,4)/p-3