(4-ethanoylphenyl) 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: (4-ethanoylphenyl) 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: (4-acetylphenyl) 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid (4-acetylphenyl) ester Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5S/c1-11(18)12-2-6-14(7-3-12)22-16(19)10-23-15-8-4-13(5-9-15)17(20)21/h2-9H,10H2,1H3