ethyl 2-(3-nitro-4-propan-2-yl-phenyl)-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-(3-nitro-4-propan-2-yl-phenyl)-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(4-isopropyl-3-nitro-phenyl)-2-oxo-acetate CAS Name: 2-(3-nitro-4-propan-2-ylphenyl)-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(3-nitro-4-propan-2-ylphenyl)-2-oxoacetate Traditional Name: 2-(4-isopropyl-3-nitro-phenyl)-2-keto-acetic acid ethyl ester Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-4-19-13(16)12(15)9-5-6-10(8(2)3)11(7-9)14(17)18/h5-8H,4H2,1-3H3