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

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-(trifluoromethyl)benzenesulfonate Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 2-(trifluoromethyl)benzenesulfonate CAS Name: 2-(trifluoromethyl)benzenesulfonic acid (6-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-ethyl-4-methyl-2-oxochromen-7-yl) 2-(trifluoromethyl)benzenesulfonate Traditional Name: 2-(trifluoromethyl)benzenesulfonic acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C19H15F3O5S MolecularWeight: 412.37961

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H15F3O5S/c1-3-12-9-13-11(2)8-18(23)26-16(13)10-15(12)27-28(24,25)17-7-5-4-6-14(17)19(20,21)22/h4-10H,3H2,1-2H3