(3,5-dinitro-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) ethanoate

Systemtic Name: (3,5-dinitro-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) ethanoate Openeye Name: (3,5-dinitro-4-oxo-cyclohexa-2,5-dien-1-yl) acetate CAS Name: acetic acid (3,5-dinitro-4-oxo-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (3,5-dinitro-4-oxocyclohexa-2,5-dien-1-yl) acetate Traditional Name: acetic acid (4-keto-3,5-dinitro-cyclohexa-2,5-dien-1-yl) ester Formula: C8H6N2O7 MolecularWeight: 242.14244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=C(C(=O)C(=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1C=C(C(=O)C(=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O7/c1-4(11)17-5-2-6(9(13)14)8(12)7(3-5)10(15)16/h2-3,5H,1H3