2-[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[(5Z)-5-[(2-hydroxy-5-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[(5Z)-5-(2-hydroxy-5-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C12H10N2O7S3 MolecularWeight: 390.412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O7S3/c15-9-2-1-8(14(17)18)5-7(9)6-10-11(16)13(12(22)23-10)3-4-24(19,20)21/h1-2,5-6,15H,3-4H2,(H,19,20,21)/b10-6-