4-[[2-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoate

Systemtic Name: 4-[[2-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoate Openeye Name: 4-[[2-[(E)-(2,4-dioxo-3-prop-2-ynyl-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[(E)-(2,4-dioxo-3-prop-2-ynyl-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoate IUPAC Name: 4-[[2-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[(E)-(2,4-diketo-3-propargyl-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate Formula: C21H14NO5S- MolecularWeight: 392.40456

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=CC2=CC=CC=C2OCC3=CC=C(C=C3)C(=O)[O-])SC1=O

Isomeric SMILES

C#CCN1C(=O)/C(=C\C2=CC=CC=C2OCC3=CC=C(C=C3)C(=O)[O-])/SC1=O

InChI

InChI=1S/C21H15NO5S/c1-2-11-22-19(23)18(28-21(22)26)12-16-5-3-4-6-17(16)27-13-14-7-9-15(10-8-14)20(24)25/h1,3-10,12H,11,13H2,(H,24,25)/p-1/b18-12+