(3-ethanoylphenyl) 2-(4-nitrophenyl)sulfonylbenzoate

Systemtic Name: (3-ethanoylphenyl) 2-(4-nitrophenyl)sulfonylbenzoate Openeye Name: (3-acetylphenyl) 2-(4-nitrophenyl)sulfonylbenzoate CAS Name: 2-(4-nitrophenyl)sulfonylbenzoic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2-(4-nitrophenyl)sulfonylbenzoate Traditional Name: 2-nosylbenzoic acid (3-acetylphenyl) ester Formula: C21H15NO7S MolecularWeight: 425.4113

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO7S/c1-14(23)15-5-4-6-17(13-15)29-21(24)19-7-2-3-8-20(19)30(27,28)18-11-9-16(10-12-18)22(25)26/h2-13H,1H3