methyl 6-iodanyl-8-methoxy-7-oxidanyl-1-oxidanylidene-isochromene-3-carboxylate

Systemtic Name: methyl 6-iodanyl-8-methoxy-7-oxidanyl-1-oxidanylidene-isochromene-3-carboxylate Openeye Name: methyl 7-hydroxy-6-iodo-8-methoxy-1-oxo-isochromene-3-carboxylate CAS Name: 7-hydroxy-6-iodo-8-methoxy-1-oxo-2-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 7-hydroxy-6-iodo-8-methoxy-1-oxoisochromene-3-carboxylate Traditional Name: 7-hydroxy-6-iodo-1-keto-8-methoxy-isochromene-3-carboxylic acid methyl ester Formula: C12H9IO6 MolecularWeight: 376.10073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1O)I)C=C(OC2=O)C(=O)OC

Isomeric SMILES

COC1=C2C(=CC(=C1O)I)C=C(OC2=O)C(=O)OC

InChI

InChI=1S/C12H9IO6/c1-17-10-8-5(3-6(13)9(10)14)4-7(11(15)18-2)19-12(8)16/h3-4,14H,1-2H3