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

Systemtic Name: 3-[methyl-[2-(3,4,5-trimethoxyphenyl)carbonyloxyethyl]sulfonio]-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]-4-oxo-chromen-2-olate CAS Name: 3-[methyl-[2-[oxo-(3,4,5-trimethoxyphenyl)methoxy]ethyl]sulfonio]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]-4-oxochromen-2-olate Traditional Name: 4-keto-3-[methyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]sulfonio]chromen-2-olate Formula: C22H22O8S MolecularWeight: 446.47028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC[S+](C)C2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC[S+](C)C2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C22H22O8S/c1-26-16-11-13(12-17(27-2)19(16)28-3)21(24)29-9-10-31(4)20-18(23)14-7-5-6-8-15(14)30-22(20)25/h5-8,11-12H,9-10H2,1-4H3