4-methyl-2,5-diphenyl-3-(trifluoromethyl)benzenesulfonic acid

Systemtic Name: 4-methyl-2,5-diphenyl-3-(trifluoromethyl)benzenesulfonic acid Openeye Name: 4-methyl-2,5-diphenyl-3-(trifluoromethyl)benzenesulfonic acid CAS Name: 4-methyl-2,5-diphenyl-3-(trifluoromethyl)benzenesulfonic acid IUPAC Name: 4-methyl-2,5-diphenyl-3-(trifluoromethyl)benzenesulfonic acid Traditional Name: 4-methyl-2,5-diphenyl-3-(trifluoromethyl)besylic acid Formula: C20H15F3O3S MolecularWeight: 392.39151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C2=CC=CC=C2)S(=O)(=O)O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C(C=C1C2=CC=CC=C2)S(=O)(=O)O)C3=CC=CC=C3)C(F)(F)F

InChI

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