copper 6-oxidanyl-9-oxidanylidene-xanthen-1-olate

Systemtic Name: copper 6-oxidanyl-9-oxidanylidene-xanthen-1-olate Openeye Name: copper 6-hydroxy-9-oxo-xanthen-1-olate CAS Name: copper 6-hydroxy-9-oxo-1-xanthenolate IUPAC Name: copper 6-hydroxy-9-oxoxanthen-1-olate Traditional Name: cupric 6-hydroxy-9-keto-xanthen-1-olate Formula: C26H14CuO8 MolecularWeight: 517.93056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)O)[O-].C1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)O)[O-].[Cu+2]

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)O)[O-].C1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3)O)[O-].[Cu+2]

InChI

InChI=1S/2C13H8O4.Cu/c2*14-7-4-5-8-11(6-7)17-10-3-1-2-9(15)12(10)13(8)16;/h2*1-6,14-15H;/q;;+2/p-2