3-bis(2-fluoranyl-3-sulfo-phenyl)phosphanyl-2-fluoranyl-benzenesulfonic acid

Systemtic Name: 3-bis(2-fluoranyl-3-sulfo-phenyl)phosphanyl-2-fluoranyl-benzenesulfonic acid Openeye Name: 3-bis(2-fluoro-3-sulfo-phenyl)phosphanyl-2-fluoro-benzenesulfonic acid CAS Name: 3-bis(2-fluoro-3-sulfophenyl)phosphino-2-fluorobenzenesulfonic acid IUPAC Name: 3-bis(2-fluoro-3-sulfophenyl)phosphanyl-2-fluorobenzenesulfonic acid Traditional Name: 3-bis(2-fluoro-3-sulfo-phenyl)phosphino-2-fluoro-besylic acid Formula: C18H12F3O9PS3 MolecularWeight: 556.446451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)S(=O)(=O)O)F)P(C2=C(C(=CC=C2)S(=O)(=O)O)F)C3=C(C(=CC=C3)S(=O)(=O)O)F

Isomeric SMILES

C1=CC(=C(C(=C1)S(=O)(=O)O)F)P(C2=C(C(=CC=C2)S(=O)(=O)O)F)C3=C(C(=CC=C3)S(=O)(=O)O)F

InChI

InChI=1S/C18H12F3O9PS3/c19-16-10(4-1-7-13(16)32(22,23)24)31(11-5-2-8-14(17(11)20)33(25,26)27)12-6-3-9-15(18(12)21)34(28,29)30/h1-9H,(H,22,23,24)(H,25,26,27)(H,28,29,30)