(5E)-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione

Systemtic Name: (5E)-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Openeye Name: (5E)-5-[(4-hydroxy-3-nitro-phenyl)methylene]-3-prop-2-ynyl-thiazolidine-2,4-dione CAS Name: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-prop-2-ynylthiazolidine-2,4-dione IUPAC Name: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Traditional Name: (5E)-5-(4-hydroxy-3-nitro-benzylidene)-3-propargyl-thiazolidine-2,4-quinone Formula: C13H8N2O5S MolecularWeight: 304.27802

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])SC1=O

Isomeric SMILES

C#CCN1C(=O)/C(=C\C2=CC(=C(C=C2)O)[N+](=O)[O-])/SC1=O

InChI

InChI=1S/C13H8N2O5S/c1-2-5-14-12(17)11(21-13(14)18)7-8-3-4-10(16)9(6-8)15(19)20/h1,3-4,6-7,16H,5H2/b11-7+