azanium 2-tert-butyl-4,6-dinitro-phenolate

Systemtic Name: azanium 2-tert-butyl-4,6-dinitro-phenolate Openeye Name: ammonium 2-tert-butyl-4,6-dinitro-phenolate CAS Name: ammonium 2-tert-butyl-4,6-dinitrophenolate IUPAC Name: azanium 2-tert-butyl-4,6-dinitrophenolate Traditional Name: ammonium 2-tert-butyl-4,6-dinitro-phenolate Formula: C10H15N3O5 MolecularWeight: 257.2432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[NH4+]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[NH4+]

InChI

InChI=1S/C10H12N2O5.H3N/c1-10(2,3)7-4-6(11(14)15)5-8(9(7)13)12(16)17;/h4-5,13H,1-3H3;1H3