[1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl] 3-nitrobenzoate

Systemtic Name: [1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl] 3-nitrobenzoate Openeye Name: (1-ethoxycarbonyl-2-oxo-propyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (1-ethoxy-1,3-dioxobutan-2-yl) ester IUPAC Name: (1-ethoxy-1,3-dioxobutan-2-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (1-carbethoxy-2-keto-propyl) ester Formula: C13H13NO7 MolecularWeight: 295.24482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO7/c1-3-20-13(17)11(8(2)15)21-12(16)9-5-4-6-10(7-9)14(18)19/h4-7,11H,3H2,1-2H3