(4-propanoylphenyl) 3-(trifluoromethyloxy)benzenesulfonate

Systemtic Name: (4-propanoylphenyl) 3-(trifluoromethyloxy)benzenesulfonate Openeye Name: (4-propanoylphenyl) 3-(trifluoromethoxy)benzenesulfonate CAS Name: 3-(trifluoromethoxy)benzenesulfonic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 3-(trifluoromethoxy)benzenesulfonate Traditional Name: 3-(trifluoromethoxy)benzenesulfonic acid (4-propionylphenyl) ester Formula: C16H13F3O5S MolecularWeight: 374.33163

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)OC(F)(F)F

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)OC(F)(F)F

InChI

InChI=1S/C16H13F3O5S/c1-2-15(20)11-6-8-12(9-7-11)24-25(21,22)14-5-3-4-13(10-14)23-16(17,18)19/h3-10H,2H2,1H3