2-methyl-4-oxidanylidene-4-thiophen-3-yl-butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-4-thiophen-3-yl-butanoic acid Openeye Name: 2-methyl-4-oxo-4-(3-thienyl)butanoic acid CAS Name: 2-methyl-4-oxo-4-(3-thiophenyl)butanoic acid IUPAC Name: 2-methyl-4-oxo-4-thiophen-3-ylbutanoic acid Traditional Name: 4-keto-2-methyl-4-(3-thienyl)butyric acid Formula: C9H10O3S MolecularWeight: 198.2389

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CSC=C1)C(=O)O

Isomeric SMILES

CC(CC(=O)C1=CSC=C1)C(=O)O

InChI

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