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

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 4-chloranyl-2-(trifluoromethyl)benzenesulfonate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 4-chloro-2-(trifluoromethyl)benzenesulfonate CAS Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 4-chloro-2-(trifluoromethyl)benzenesulfonate Traditional Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C17H10ClF3O5S MolecularWeight: 418.77151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H10ClF3O5S/c1-9-6-16(22)25-14-8-11(3-4-12(9)14)26-27(23,24)15-5-2-10(18)7-13(15)17(19,20)21/h2-8H,1H3