[2-methoxy-5-[3,5,7-tris(oxidanyl)-4-oxidanylidene-chromen-2-yl]phenyl] hydrogen sulfate

Systemtic Name: [2-methoxy-5-[3,5,7-tris(oxidanyl)-4-oxidanylidene-chromen-2-yl]phenyl] hydrogen sulfate Openeye Name: [2-methoxy-5-(3,5,7-trihydroxy-4-oxo-chromen-2-yl)phenyl] hydrogen sulfate CAS Name: sulfuric acid [2-methoxy-5-(3,5,7-trihydroxy-4-oxo-1-benzopyran-2-yl)phenyl] ester IUPAC Name: [2-methoxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenyl] hydrogen sulfate Traditional Name: sulfuric acid [2-methoxy-5-(3,5,7-trihydroxy-4-keto-chromen-2-yl)phenyl] ester Formula: C16H12O10S MolecularWeight: 396.32548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)OS(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)OS(=O)(=O)O

InChI

InChI=1S/C16H12O10S/c1-24-10-3-2-7(4-11(10)26-27(21,22)23)16-15(20)14(19)13-9(18)5-8(17)6-12(13)25-16/h2-6,17-18,20H,1H3,(H,21,22,23)