4-[(3-oxidanylidene-1-benzofuran-6-yl)oxymethyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(3-oxidanylidene-1-benzofuran-6-yl)oxymethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(3-oxobenzofuran-6-yl)oxymethyl]thiazole-2-carboxylic acid CAS Name: 4-[(3-oxo-6-benzofuranyl)oxymethyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(3-oxo-1-benzofuran-6-yl)oxymethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(3-ketocoumaran-6-yl)oxymethyl]thiazole-2-carboxylic acid Formula: C13H9NO5S MolecularWeight: 291.27926

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=C(O1)C=C(C=C2)OCC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1C(=O)C2=C(O1)C=C(C=C2)OCC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C13H9NO5S/c15-10-5-19-11-3-8(1-2-9(10)11)18-4-7-6-20-12(14-7)13(16)17/h1-3,6H,4-5H2,(H,16,17)