methyl 4-[7-methylsulfonyloxy-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate

Systemtic Name: methyl 4-[7-methylsulfonyloxy-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[7-methylsulfonyloxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate CAS Name: 4-[[7-methylsulfonyloxy-4-oxo-2-(trifluoromethyl)-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[7-methylsulfonyloxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Traditional Name: 4-[4-keto-7-methylsulfonyloxy-2-(trifluoromethyl)chromen-3-yl]oxybenzoic acid methyl ester Formula: C19H13F3O8S MolecularWeight: 458.36193

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C19H13F3O8S/c1-27-18(24)10-3-5-11(6-4-10)28-16-15(23)13-8-7-12(30-31(2,25)26)9-14(13)29-17(16)19(20,21)22/h3-9H,1-2H3