3-nitro-2-oxidanyl-5-sulfo-benzenediazonium tetratetrafluoroborate

Systemtic Name: 3-nitro-2-oxidanyl-5-sulfo-benzenediazonium tetratetrafluoroborate Openeye Name: 2-hydroxy-3-nitro-5-sulfo-benzenediazonium tetratetrafluoroborate CAS Name: 2-hydroxy-3-nitro-5-sulfobenzenediazonium tetratetrafluoroborate IUPAC Name: 2-hydroxy-3-nitro-5-sulfobenzenediazonium tetratetrafluoroborate Traditional Name: 2-hydroxy-3-nitro-5-sulfo-benzenediazonium tetratetrafluoroborate Formula: C6H4B4F16N3O6S-3 MolecularWeight: 593.395911

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+]#N)S(=O)(=O)O

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+]#N)S(=O)(=O)O

InChI

InChI=1S/C6H3N3O6S.4BF4/c7-8-4-1-3(16(13,14)15)2-5(6(4)10)9(11)12;4*2-1(3,4)5/h1-2H,(H-,10,13,14,15);;;;/q;4*-1/p+1