(4-ethanoylphenyl) 4-ethoxy-3-nitro-benzoate

Systemtic Name: (4-ethanoylphenyl) 4-ethoxy-3-nitro-benzoate Openeye Name: (4-acetylphenyl) 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid (4-acetylphenyl) ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-3-23-16-9-6-13(10-15(16)18(21)22)17(20)24-14-7-4-12(5-8-14)11(2)19/h4-10H,3H2,1-2H3