6-methanoyl-3-methyl-2,4-dinitro-phenolate

Systemtic Name: 6-methanoyl-3-methyl-2,4-dinitro-phenolate Openeye Name: 6-formyl-3-methyl-2,4-dinitro-phenolate CAS Name: 6-formyl-3-methyl-2,4-dinitrophenolate IUPAC Name: 6-formyl-3-methyl-2,4-dinitrophenolate Traditional Name: 6-formyl-3-methyl-2,4-dinitro-phenolate Formula: C8H5N2O6- MolecularWeight: 225.1351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1[N+](=O)[O-])[O-])C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C(=C1[N+](=O)[O-])[O-])C=O)[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O6/c1-4-6(9(13)14)2-5(3-11)8(12)7(4)10(15)16/h2-3,12H,1H3/p-1