(4-ethyl-2-oxidanylidene-chromen-7-yl) 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: (4-ethyl-2-oxidanylidene-chromen-7-yl) 3-(trifluoromethyl)benzenesulfonate Openeye Name: (4-ethyl-2-oxo-chromen-7-yl) 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid (4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-2-oxochromen-7-yl) 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid (4-ethyl-2-keto-chromen-7-yl) ester Formula: C18H13F3O5S MolecularWeight: 398.35303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3O5S/c1-2-11-8-17(22)25-16-10-13(6-7-15(11)16)26-27(23,24)14-5-3-4-12(9-14)18(19,20)21/h3-10H,2H2,1H3