bismuth (4-nitro-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)oxidanium

Systemtic Name: bismuth (4-nitro-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)oxidanium Openeye Name: bismuth (4-nitro-7-oxo-cyclohepta-1,3,5-trien-1-yl)oxonium CAS Name: bismuth (4-nitro-7-oxo-1-cyclohepta-1,3,5-trienyl)oxonium IUPAC Name: bismuth (4-nitro-7-oxocyclohepta-1,3,5-trien-1-yl)oxidanium Traditional Name: bismuth (7-keto-4-nitro-cyclohepta-1,3,5-trien-1-yl)oxonium Formula: C21H18BiN3O12+6 MolecularWeight: 713.3609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].[Bi+3]

Isomeric SMILES

C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=O)C(=CC=C1[N+](=O)[O-])[OH2+].[Bi+3]

InChI

InChI=1S/3C7H5NO4.Bi/c3*9-6-3-1-5(8(11)12)2-4-7(6)10;/h3*1-4H,(H,9,10);/q;;;+3/p+3