methyl 3-[8-iodanyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-4-yl]propanoate

Systemtic Name: methyl 3-[8-iodanyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-4-yl]propanoate Openeye Name: methyl 3-(5,7-dihydroxy-8-iodo-2-oxo-chromen-4-yl)propanoate CAS Name: 3-(5,7-dihydroxy-8-iodo-2-oxo-1-benzopyran-4-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(5,7-dihydroxy-8-iodo-2-oxochromen-4-yl)propanoate Traditional Name: 3-(5,7-dihydroxy-8-iodo-2-keto-chromen-4-yl)propionic acid methyl ester Formula: C13H11IO6 MolecularWeight: 390.12731

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=O)OC2=C1C(=CC(=C2I)O)O

Isomeric SMILES

COC(=O)CCC1=CC(=O)OC2=C1C(=CC(=C2I)O)O

InChI

InChI=1S/C13H11IO6/c1-19-9(17)3-2-6-4-10(18)20-13-11(6)7(15)5-8(16)12(13)14/h4-5,15-16H,2-3H2,1H3