1,3-dinitrobenzene; 1,4-dinitrobenzene

Systemtic Name: 1,3-dinitrobenzene; 1,4-dinitrobenzene Openeye Name: 1,3-dinitrobenzene; 1,4-dinitrobenzene CAS Name: 1,3-dinitrobenzene; 1,4-dinitrobenzene IUPAC Name: 1,3-dinitrobenzene; 1,4-dinitrobenzene Traditional Name: 1,3-dinitrobenzene; 1,4-dinitrobenzene Formula: C12H8N4O8 MolecularWeight: 336.21392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12;9-7(10)5-2-1-3-6(4-5)8(11)12/h2*1-4H