2-methyl-4-oxidanylidene-4-thiophen-2-yl-butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-4-thiophen-2-yl-butanoic acid Openeye Name: 2-methyl-4-oxo-4-(2-thienyl)butanoic acid CAS Name: 2-methyl-4-oxo-4-thiophen-2-ylbutanoic acid IUPAC Name: 2-methyl-4-oxo-4-thiophen-2-ylbutanoic acid Traditional Name: 4-keto-2-methyl-4-(2-thienyl)butyric acid Formula: C9H10O3S MolecularWeight: 198.2389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O3S/c1-6(9(11)12)5-7(10)8-3-2-4-13-8/h2-4,6H,5H2,1H3,(H,11,12)