3-[[5-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 3-[[5-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[5-[(3-ethoxy-4-hydroxy-5-iodo-phenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 3-[[5-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 3-[[5-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 3-[[5-(3-ethoxy-4-hydroxy-5-iodo-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid Formula: C20H17IN2O5S MolecularWeight: 524.32885

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C)I)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C)I)O

InChI

InChI=1S/C20H17IN2O5S/c1-3-28-15-8-11(7-14(21)17(15)24)9-16-18(25)23(2)20(29-16)22-13-6-4-5-12(10-13)19(26)27/h4-10,24H,3H2,1-2H3,(H,26,27)