1,1'-biphenyl; [4-(2-methylpropyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: 1,1'-biphenyl; [4-(2-methylpropyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: biphenyl; (4-isobutylphenyl) trifluoromethanesulfonate CAS Name: 1,1'-biphenyl; trifluoromethanesulfonic acid [4-(2-methylpropyl)phenyl] ester IUPAC Name: 1,1'-biphenyl; [4-(2-methylpropyl)phenyl] trifluoromethanesulfonate Traditional Name: biphenyl; trifluoromethanesulfonic acid (4-isobutylphenyl) ester Formula: C23H23F3O3S MolecularWeight: 436.48713

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F.C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F.C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C12H10.C11H13F3O3S/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-8(2)7-9-3-5-10(6-4-9)17-18(15,16)11(12,13)14/h1-10H;3-6,8H,7H2,1-2H3