2-methyl-5,7-dinitro-quinazolin-4-olate

Systemtic Name: 2-methyl-5,7-dinitro-quinazolin-4-olate Openeye Name: 2-methyl-5,7-dinitro-quinazolin-4-olate CAS Name: 2-methyl-5,7-dinitro-4-quinazolinolate IUPAC Name: 2-methyl-5,7-dinitroquinazolin-4-olate Traditional Name: 2-methyl-5,7-dinitro-quinazolin-4-olate Formula: C9H5N4O5- MolecularWeight: 249.1598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=CC(=C2C(=N1)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC(=CC(=C2C(=N1)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H6N4O5/c1-4-10-6-2-5(12(15)16)3-7(13(17)18)8(6)9(14)11-4/h2-3H,1H3,(H,10,11,14)/p-1