4-methoxycarbonyl-2,6-dinitro-phenolate

Systemtic Name: 4-methoxycarbonyl-2,6-dinitro-phenolate Openeye Name: 4-methoxycarbonyl-2,6-dinitro-phenolate CAS Name: 4-methoxycarbonyl-2,6-dinitrophenolate IUPAC Name: 4-methoxycarbonyl-2,6-dinitrophenolate Traditional Name: 4-carbomethoxy-2,6-dinitro-phenolate Formula: C8H5N2O7- MolecularWeight: 241.1345

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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