4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate

Systemtic Name: 4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate Openeye Name: 4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate CAS Name: 4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate IUPAC Name: 4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate Traditional Name: 4,5-dinitro-7,8-dithiabicyclo[4.2.0]octa-1(6),2,4-triene-2-carboxylate Formula: C7HN2O6S2- MolecularWeight: 273.22264

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])SS2)C(=O)[O-]

Isomeric SMILES

C1=C(C2=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])SS2)C(=O)[O-]

InChI

InChI=1S/C7H2N2O6S2/c10-7(11)2-1-3(8(12)13)4(9(14)15)6-5(2)16-17-6/h1H,(H,10,11)/p-1