2-acetyloxyethanoate; 2-chloranyl-4-nitro-benzoate

Systemtic Name: 2-acetyloxyethanoate; 2-chloranyl-4-nitro-benzoate Openeye Name: 2-acetoxyacetate; 2-chloro-4-nitro-benzoate CAS Name: 2-acetyloxyacetate; 2-chloro-4-nitrobenzoate IUPAC Name: 2-acetyloxyacetate; 2-chloro-4-nitrobenzoate Traditional Name: 2-acetoxyacetate; 2-chloro-4-nitro-benzoate Formula: C11H8ClNO8-2 MolecularWeight: 317.63612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)[O-]

Isomeric SMILES

CC(=O)OCC(=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)[O-]

InChI

InChI=1S/C7H4ClNO4.C4H6O4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11;1-3(5)8-2-4(6)7/h1-3H,(H,10,11);2H2,1H3,(H,6,7)/p-2