(4-ethanoylphenyl) 4-nitrobenzenesulfonate

Systemtic Name: (4-ethanoylphenyl) 4-nitrobenzenesulfonate Openeye Name: (4-acetylphenyl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (4-acetylphenyl) ester Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO6S/c1-10(16)11-2-6-13(7-3-11)21-22(19,20)14-8-4-12(5-9-14)15(17)18/h2-9H,1H3