(6,7-dimethoxy-8-oxidanyl-9-oxidanylidene-xanthen-4-yl) hydrogen sulfate

Systemtic Name: (6,7-dimethoxy-8-oxidanyl-9-oxidanylidene-xanthen-4-yl) hydrogen sulfate Openeye Name: (8-hydroxy-6,7-dimethoxy-9-oxo-xanthen-4-yl) hydrogen sulfate CAS Name: sulfuric acid (8-hydroxy-6,7-dimethoxy-9-oxo-4-xanthenyl) ester IUPAC Name: (8-hydroxy-6,7-dimethoxy-9-oxoxanthen-4-yl) hydrogen sulfate Traditional Name: sulfuric acid (8-hydroxy-9-keto-6,7-dimethoxy-xanthen-4-yl) ester Formula: C15H12O9S MolecularWeight: 368.31538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)OC3=C(C2=O)C=CC=C3OS(=O)(=O)O)O)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)OC3=C(C2=O)C=CC=C3OS(=O)(=O)O)O)OC

InChI

InChI=1S/C15H12O9S/c1-21-10-6-9-11(13(17)15(10)22-2)12(16)7-4-3-5-8(14(7)23-9)24-25(18,19)20/h3-6,17H,1-2H3,(H,18,19,20)