3-oxidanylidene-2-thiophen-2-ylcarbonyl-butanoic acid

Systemtic Name: 3-oxidanylidene-2-thiophen-2-ylcarbonyl-butanoic acid Openeye Name: 3-oxo-2-(thiophene-2-carbonyl)butanoic acid CAS Name: 3-oxo-2-[oxo(thiophen-2-yl)methyl]butanoic acid IUPAC Name: 3-oxo-2-(thiophene-2-carbonyl)butanoic acid Traditional Name: 3-keto-2-(2-thenoyl)butyric acid Formula: C9H8O4S MolecularWeight: 212.22242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C1=CC=CS1)C(=O)O

Isomeric SMILES

CC(=O)C(C(=O)C1=CC=CS1)C(=O)O

InChI

InChI=1S/C9H8O4S/c1-5(10)7(9(12)13)8(11)6-3-2-4-14-6/h2-4,7H,1H3,(H,12,13)