azanylidyneazanium; 2-bromanyl-4,6-dinitro-aniline; sulfate

Systemtic Name: azanylidyneazanium; 2-bromanyl-4,6-dinitro-aniline; sulfate Openeye Name: 2-bromo-4,6-dinitro-aniline; nitridoammonium; sulfate CAS Name: 2-bromo-4,6-dinitroaniline; nitriloammonium; sulfate IUPAC Name: azanylidyneazanium; 2-bromo-4,6-dinitroaniline; sulfate Traditional Name: (2-bromo-4,6-dinitro-phenyl)amine; nitriloammonium; sulfate Formula: C6H5BrN5O8S- MolecularWeight: 387.1016

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)[N+](=O)[O-].[NH+]#N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)[N+](=O)[O-].[NH+]#N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C6H4BrN3O4.N2.H2O4S/c7-4-1-3(9(11)12)2-5(6(4)8)10(13)14;1-2;1-5(2,3)4/h1-2H,8H2;;(H2,1,2,3,4)/p-1