(2-ethanoylphenyl) 2-(2-nitrophenyl)sulfanylbenzoate

Systemtic Name: (2-ethanoylphenyl) 2-(2-nitrophenyl)sulfanylbenzoate Openeye Name: (2-acetylphenyl) 2-(2-nitrophenyl)sulfanylbenzoate CAS Name: 2-[(2-nitrophenyl)thio]benzoic acid (2-acetylphenyl) ester IUPAC Name: (2-acetylphenyl) 2-(2-nitrophenyl)sulfanylbenzoate Traditional Name: 2-[(2-nitrophenyl)thio]benzoic acid (2-acetylphenyl) ester Formula: C21H15NO5S MolecularWeight: 393.4125

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OC(=O)C2=CC=CC=C2SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=CC=C1OC(=O)C2=CC=CC=C2SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H15NO5S/c1-14(23)15-8-2-5-11-18(15)27-21(24)16-9-3-6-12-19(16)28-20-13-7-4-10-17(20)22(25)26/h2-13H,1H3