5-nitro-2-oxidanyl-cyclohepta-2,4,6-trien-1-one; nitrooxybismuth

Systemtic Name: 5-nitro-2-oxidanyl-cyclohepta-2,4,6-trien-1-one; nitrooxybismuth Openeye Name: 2-hydroxy-5-nitro-cyclohepta-2,4,6-trien-1-one; nitrooxybismuth CAS Name: 2-hydroxy-5-nitro-1-cyclohepta-2,4,6-trienone; nitrooxybismuth IUPAC Name: 2-hydroxy-5-nitrocyclohepta-2,4,6-trien-1-one; nitrooxybismuth Traditional Name: 2-hydroxy-5-nitro-cyclohepta-2,4,6-trien-1-one; nitrooxybismuth Formula: C14H10BiN3O11 MolecularWeight: 605.22308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC=C1[N+](=O)[O-])O.C1=CC(=O)C(=CC=C1[N+](=O)[O-])O.[N+](=O)([O-])O[Bi]

Isomeric SMILES

C1=CC(=O)C(=CC=C1[N+](=O)[O-])O.C1=CC(=O)C(=CC=C1[N+](=O)[O-])O.[N+](=O)([O-])O[Bi]

InChI

InChI=1S/2C7H5NO4.Bi.NO3/c2*9-6-3-1-5(8(11)12)2-4-7(6)10;;2-1(3)4/h2*1-4H,(H,9,10);;/q;;+1;-1