[2-fluoranyl-6-[[3-fluoranyl-2-(4-methylphenyl)sulfonyloxy-phenyl]-diphenyl-methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-fluoranyl-6-[[3-fluoranyl-2-(4-methylphenyl)sulfonyloxy-phenyl]-diphenyl-methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-fluoro-6-[[3-fluoro-2-(p-tolylsulfonyloxy)phenyl]-diphenyl-methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-fluoro-6-[[3-fluoro-2-(4-methylphenyl)sulfonyloxyphenyl]-diphenylmethyl]phenyl] ester IUPAC Name: [2-fluoro-6-[[3-fluoro-2-(4-methylphenyl)sulfonyloxyphenyl]-diphenylmethyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-fluoro-6-[(3-fluoro-2-tosyloxy-phenyl)-diphenyl-methyl]phenyl] ester Formula: C39H30F2O6S2 MolecularWeight: 696.778706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2F)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=C(C(=CC=C5)F)OS(=O)(=O)C6=CC=C(C=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2F)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=C(C(=CC=C5)F)OS(=O)(=O)C6=CC=C(C=C6)C

InChI

InChI=1S/C39H30F2O6S2/c1-27-19-23-31(24-20-27)48(42,43)46-37-33(15-9-17-35(37)40)39(29-11-5-3-6-12-29,30-13-7-4-8-14-30)34-16-10-18-36(41)38(34)47-49(44,45)32-25-21-28(2)22-26-32/h3-26H,1-2H3