bismuth (5-nitro-2-oxidaniumyl-cyclohepta-2,4,6-trien-1-ylidene)oxidanium

Systemtic Name: bismuth (5-nitro-2-oxidaniumyl-cyclohepta-2,4,6-trien-1-ylidene)oxidanium Openeye Name: bismuth (5-nitro-2-oxonio-cyclohepta-2,4,6-trien-1-ylidene)oxonium CAS Name: bismuth (5-nitro-2-oxonio-1-cyclohepta-2,4,6-trienylidene)oxonium IUPAC Name: bismuth (5-nitro-2-oxoniocyclohepta-2,4,6-trien-1-ylidene)oxidanium Traditional Name: bismuth (5-nitro-2-oxonio-cyclohepta-2,4,6-trien-1-ylidene)oxonium Formula: C21H21BiN3O12+9 MolecularWeight: 716.38472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=[OH+])C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=[OH+])C(=CC=C1[N+](=O)[O-])[OH2+].C1=CC(=[OH+])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+6