methyl 3-[[3-ethyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: methyl 3-[[3-ethyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: methyl 3-[[3-ethyl-5-[(4-hydroxy-3-nitro-phenyl)methylene]-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 3-[[3-ethyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-2-thiazolidinylidene]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-ethyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 3-[[3-ethyl-5-(4-hydroxy-3-nitro-benzylidene)-4-keto-thiazolidin-2-ylidene]amino]benzoic acid methyl ester Formula: C20H17N3O6S MolecularWeight: 427.43048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O6S/c1-3-22-18(25)17(10-12-7-8-16(24)15(9-12)23(27)28)30-20(22)21-14-6-4-5-13(11-14)19(26)29-2/h4-11,24H,3H2,1-2H3