pentapotassium 2-[bis(oxidanidyl)amino]-4,6-dinitro-3-oxidanyl-phenolate hexahydroxide

Systemtic Name: pentapotassium 2-[bis(oxidanidyl)amino]-4,6-dinitro-3-oxidanyl-phenolate hexahydroxide Openeye Name: pentapotassium 2-(dioxidoamino)-3-hydroxy-4,6-dinitro-phenolate hexahydroxide CAS Name: pentapotassium 2-(dioxidoamino)-3-hydroxy-4,6-dinitrophenolate hexahydroxide IUPAC Name: pentapotassium 2-(dioxidoamino)-3-hydroxy-4,6-dinitrophenolate hexahydroxide Traditional Name: pentapotassium 2-(dioxidoamino)-3-hydroxy-4,6-dinitro-phenolate hexahydroxide Formula: C6H8K5N3O14-4 MolecularWeight: 541.63092

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1[N+](=O)[O-])O)N([O-])[O-])[O-])[N+](=O)[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[K+].[K+].[K+].[K+].[K+]

Isomeric SMILES

C1=C(C(=C(C(=C1[N+](=O)[O-])O)N([O-])[O-])[O-])[N+](=O)[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[K+].[K+].[K+].[K+].[K+]

InChI

InChI=1S/C6H3N3O8.5K.6H2O/c10-5-2(7(12)13)1-3(8(14)15)6(11)4(5)9(16)17;;;;;;;;;;;/h1,10-11H;;;;;;6*1H2/q-2;5*+1;;;;;;/p-7