5-(4-nitrophenyl)-2H-1,2,3,4-tetrazol-1-ium sulfate

Systemtic Name: 5-(4-nitrophenyl)-2H-1,2,3,4-tetrazol-1-ium sulfate Openeye Name: 5-(4-nitrophenyl)-2H-tetrazol-1-ium sulfate CAS Name: 5-(4-nitrophenyl)-2H-tetrazol-1-ium sulfate IUPAC Name: 5-(4-nitrophenyl)-2H-tetrazol-1-ium sulfate Traditional Name: 5-(4-nitrophenyl)-2H-tetrazol-1-ium sulfate Formula: C14H12N10O8S MolecularWeight: 480.37228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=[NH+]NN=N2)[N+](=O)[O-].C1=CC(=CC=C1C2=[NH+]NN=N2)[N+](=O)[O-].[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=[NH+]NN=N2)[N+](=O)[O-].C1=CC(=CC=C1C2=[NH+]NN=N2)[N+](=O)[O-].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C7H5N5O2.H2O4S/c2*13-12(14)6-3-1-5(2-4-6)7-8-10-11-9-7;1-5(2,3)4/h2*1-4H,(H,8,9,10,11);(H2,1,2,3,4)