3-[(5E)-5-[(3-nitro-4-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate

Systemtic Name: 3-[(5E)-5-[(3-nitro-4-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Openeye Name: 3-[(5E)-5-[(3-nitro-4-oxido-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoate CAS Name: 3-[(5E)-5-[(3-nitro-4-oxidophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoate IUPAC Name: 3-[(5E)-5-[(3-nitro-4-oxidophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Traditional Name: 3-[(5E)-4-keto-5-(3-nitro-4-oxido-benzylidene)-2-thioxo-thiazolidin-3-yl]benzoate Formula: C17H8N2O6S2-2 MolecularWeight: 400.38522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])SC2=S)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/SC2=S)C(=O)[O-]

InChI

InChI=1S/C17H10N2O6S2/c20-13-5-4-9(6-12(13)19(24)25)7-14-15(21)18(17(26)27-14)11-3-1-2-10(8-11)16(22)23/h1-8,20H,(H,22,23)/p-2/b14-7+