potassium 4-azanyl-3,5-dinitro-benzenesulfonate

Systemtic Name: potassium 4-azanyl-3,5-dinitro-benzenesulfonate Openeye Name: potassium 4-amino-3,5-dinitro-benzenesulfonate CAS Name: potassium 4-amino-3,5-dinitrobenzenesulfonate IUPAC Name: potassium 4-amino-3,5-dinitrobenzenesulfonate Traditional Name: potassium 4-amino-3,5-dinitro-besylate Formula: C6H4KN3O7S MolecularWeight: 301.27516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5N3O7S.K/c7-6-4(8(10)11)1-3(17(14,15)16)2-5(6)9(12)13;/h1-2H,7H2,(H,14,15,16);/q;+1/p-1