6-fluoranyl-3-[methyl-[2-(3,4,5-trimethoxyphenyl)carbonyloxyethyl]sulfonio]-4-oxidanylidene-chromen-2-olate

Systemtic Name: 6-fluoranyl-3-[methyl-[2-(3,4,5-trimethoxyphenyl)carbonyloxyethyl]sulfonio]-4-oxidanylidene-chromen-2-olate Openeye Name: 6-fluoro-3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]-4-oxo-chromen-2-olate CAS Name: 6-fluoro-3-[methyl-[2-[oxo-(3,4,5-trimethoxyphenyl)methoxy]ethyl]sulfonio]-4-oxo-1-benzopyran-2-olate IUPAC Name: 6-fluoro-3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]-4-oxochromen-2-olate Traditional Name: 6-fluoro-4-keto-3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]chromen-2-olate Formula: C22H21FO8S MolecularWeight: 464.460743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC[S+](C)C2=C(OC3=C(C2=O)C=C(C=C3)F)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC[S+](C)C2=C(OC3=C(C2=O)C=C(C=C3)F)[O-]

InChI

InChI=1S/C22H21FO8S/c1-27-16-9-12(10-17(28-2)19(16)29-3)21(25)30-7-8-32(4)20-18(24)14-11-13(23)5-6-15(14)31-22(20)26/h5-6,9-11H,7-8H2,1-4H3