2-(4-methanoyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: 2-(4-methanoyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: 2-(4-formyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-formyl-2-nitrophenyl)thio]acetate IUPAC Name: 2-(4-formyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-formyl-2-nitro-phenyl)thio]acetate Formula: C9H6NO5S- MolecularWeight: 240.21264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=O)[N+](=O)[O-])SCC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C=O)[N+](=O)[O-])SCC(=O)[O-]

InChI

InChI=1S/C9H7NO5S/c11-4-6-1-2-8(16-5-9(12)13)7(3-6)10(14)15/h1-4H,5H2,(H,12,13)/p-1