1-[3,5-dinitro-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[3,5-dinitro-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(2,4-dihydroxy-3,5-dinitro-phenyl)ethanone CAS Name: 1-(2,4-dihydroxy-3,5-dinitrophenyl)ethanone IUPAC Name: 1-(2,4-dihydroxy-3,5-dinitrophenyl)ethanone Traditional Name: 1-(2,4-dihydroxy-3,5-dinitro-phenyl)ethanone Formula: C8H6N2O7 MolecularWeight: 242.14244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1O)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1O)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

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