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

Systemtic Name: 4-methyl-3-[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 3-[(5Z)-5-[(2-hydroxy-5-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-4-methyl-benzoic acid CAS Name: 3-[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-methylbenzoic acid IUPAC Name: 3-[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylbenzoic acid Traditional Name: 3-[(5Z)-5-(2-hydroxy-5-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-4-methyl-benzoic acid Formula: C18H12N2O6S2 MolecularWeight: 416.42768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])O)SC2=S

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])O)/SC2=S

InChI

InChI=1S/C18H12N2O6S2/c1-9-2-3-10(17(23)24)7-13(9)19-16(22)15(28-18(19)27)8-11-6-12(20(25)26)4-5-14(11)21/h2-8,21H,1H3,(H,23,24)/b15-8-