3-[5-[1-(3-nitrophenyl)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[5-[1-(3-nitrophenyl)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[5-[1-(3-nitrophenyl)ethylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[5-[1-(3-nitrophenyl)ethylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[5-[1-(3-nitrophenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[4-keto-5-[1-(3-nitrophenyl)ethylidene]-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C14H12N2O5S2 MolecularWeight: 352.38548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)N(C(=S)S1)CCC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=C1C(=O)N(C(=S)S1)CCC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5S2/c1-8(9-3-2-4-10(7-9)16(20)21)12-13(19)15(14(22)23-12)6-5-11(17)18/h2-4,7H,5-6H2,1H3,(H,17,18)