4-[[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[(5Z)-5-[(4,5-dimethoxy-2-nitro-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[(5Z)-5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[(5Z)-5-[(4,5-dimethoxy-2-nitrophenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[(5Z)-5-(4,5-dimethoxy-2-nitro-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H19N3O7S MolecularWeight: 457.45646

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)SC1=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCN1C(=O)/C(=C/C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)/SC1=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H19N3O7S/c1-4-23-19(25)18(32-21(23)22-14-7-5-12(6-8-14)20(26)27)10-13-9-16(30-2)17(31-3)11-15(13)24(28)29/h5-11H,4H2,1-3H3,(H,26,27)/b18-10-,22-21?