[2',7'-bis(bromanyl)-3',6'-bis(oxidanyl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-1'-yl]mercury hydrate

Systemtic Name: [2',7'-bis(bromanyl)-3',6'-bis(oxidanyl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-1'-yl]mercury hydrate Openeye Name: (2',7'-dibromo-3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-1'-yl)mercury hydrate CAS Name: (2',7'-dibromo-3',6'-dihydroxy-3-oxo-1'-spiro[isobenzofuran-1,9'-xanthene]yl)mercury hydrate IUPAC Name: (2',7'-dibromo-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-1'-yl)mercury hydrate Traditional Name: (2',7'-dibromo-3',6'-dihydroxy-3-keto-spiro[phthalan-1,9'-xanthene]-1'-yl)mercury hydrate Formula: C20H11Br2HgO6 MolecularWeight: 707.69574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C(=C35)[Hg])Br)O)O)Br.O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C(=C35)[Hg])Br)O)O)Br.O

InChI

InChI=1S/C20H9Br2O5.Hg.H2O/c21-13-5-11-17(7-15(13)23)26-18-8-16(24)14(22)6-12(18)20(11)10-4-2-1-3-9(10)19(25)27-20;;/h1-5,7-8,23-24H;;1H2