2-(2-fluoranyl-6-oxidanyl-3-phenylmethoxy-phenyl)sulfanyl-2-(3-hydroxyphenyl)-1-(4-phosphanylsulfanyloxyphenyl)ethanone; thallium

Systemtic Name: 2-(2-fluoranyl-6-oxidanyl-3-phenylmethoxy-phenyl)sulfanyl-2-(3-hydroxyphenyl)-1-(4-phosphanylsulfanyloxyphenyl)ethanone; thallium Openeye Name: 2-(3-benzyloxy-2-fluoro-6-hydroxy-phenyl)sulfanyl-2-(3-hydroxyphenyl)-1-(4-phosphanylsulfanyloxyphenyl)ethanone; thallium CAS Name: 3-fluoro-1-hydroxy-2-[[1-(3-hydroxyphenyl)-2-oxo-2-[4-(phosphinothio)oxyphenyl]ethyl]thio]-4-phenylmethoxybenzene; thallium IUPAC Name: 2-(2-fluoro-6-hydroxy-3-phenylmethoxyphenyl)sulfanyl-2-(3-hydroxyphenyl)-1-(4-phosphanylsulfanyloxyphenyl)ethanone; thallium Traditional Name: 2-[(3-benzoxy-2-fluoro-6-hydroxy-phenyl)thio]-2-(3-hydroxyphenyl)-1-[4-(phosphinothio)oxyphenyl]ethanone; thallium Formula: C27H22FO5PS2Tl MolecularWeight: 744.946044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)O)SC(C3=CC(=CC=C3)O)C(=O)C4=CC=C(C=C4)OSP)F.[Tl]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=C(C=C2)O)SC(C3=CC(=CC=C3)O)C(=O)C4=CC=C(C=C4)OSP)F.[Tl]

InChI

InChI=1S/C27H22FO5PS2.Tl/c28-24-23(32-16-17-5-2-1-3-6-17)14-13-22(30)27(24)35-26(19-7-4-8-20(29)15-19)25(31)18-9-11-21(12-10-18)33-36-34;/h1-15,26,29-30H,16,34H2;