(2-methyl-1-oxidanylidene-propan-2-yl) 3,5-dinitrobenzoate

Systemtic Name: (2-methyl-1-oxidanylidene-propan-2-yl) 3,5-dinitrobenzoate Openeye Name: (1,1-dimethyl-2-oxo-ethyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (2-methyl-1-oxopropan-2-yl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-keto-1,1-dimethyl-ethyl) ester Formula: C11H10N2O7 MolecularWeight: 282.2063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2O7/c1-11(2,6-14)20-10(15)7-3-8(12(16)17)5-9(4-7)13(18)19/h3-6H,1-2H3