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

Systemtic Name: 2-[(5E)-5-[(2-methoxy-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5E)-5-[(2-methoxy-3-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[(2-methoxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5E)-5-[(2-methoxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-4-keto-5-(2-methoxy-3-nitro-benzylidene)-2-thioxo-thiazolidin-3-yl]acetate Formula: C13H9N2O6S2- MolecularWeight: 353.35036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1[N+](=O)[O-])C=C2C(=O)N(C(=S)S2)CC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC=C1[N+](=O)[O-])/C=C/2\C(=O)N(C(=S)S2)CC(=O)[O-]

InChI

InChI=1S/C13H10N2O6S2/c1-21-11-7(3-2-4-8(11)15(19)20)5-9-12(18)14(6-10(16)17)13(22)23-9/h2-5H,6H2,1H3,(H,16,17)/p-1/b9-5+