phenyl 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonate

Systemtic Name: phenyl 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonate Openeye Name: phenyl 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonate CAS Name: 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonate Traditional Name: 4-methyl-2-phenyl-3-(trifluoromethyl)benzenesulfonic acid phenyl ester Formula: C20H15F3O3S MolecularWeight: 392.39151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3O3S/c1-14-12-13-17(27(24,25)26-16-10-6-3-7-11-16)18(19(14)20(21,22)23)15-8-4-2-5-9-15/h2-13H,1H3