(6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2,3,4-tris(fluoranyl)benzenesulfonate

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2,3,4-tris(fluoranyl)benzenesulfonate Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 2,3,4-trifluorobenzenesulfonate CAS Name: 2,3,4-trifluorobenzenesulfonic acid (6-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-ethyl-4-methyl-2-oxochromen-7-yl) 2,3,4-trifluorobenzenesulfonate Traditional Name: 2,3,4-trifluorobenzenesulfonic acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C18H13F3O5S MolecularWeight: 398.35303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=C(C(=C(C=C3)F)F)F

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=C(C(=C(C=C3)F)F)F

InChI

InChI=1S/C18H13F3O5S/c1-3-10-7-11-9(2)6-16(22)25-14(11)8-13(10)26-27(23,24)15-5-4-12(19)17(20)18(15)21/h4-8H,3H2,1-2H3