(3S)-3-methyl-5-oxidanylidene-5-thiophen-2-yl-pentanoic acid

Systemtic Name: (3S)-3-methyl-5-oxidanylidene-5-thiophen-2-yl-pentanoic acid Openeye Name: (3S)-3-methyl-5-oxo-5-(2-thienyl)pentanoic acid CAS Name: (3S)-3-methyl-5-oxo-5-thiophen-2-ylpentanoic acid IUPAC Name: (3S)-3-methyl-5-oxo-5-thiophen-2-ylpentanoic acid Traditional Name: (3S)-5-keto-3-methyl-5-(2-thienyl)valeric acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CC(=O)C1=CC=CS1)CC(=O)O

InChI

InChI=1S/C10H12O3S/c1-7(6-10(12)13)5-8(11)9-3-2-4-14-9/h2-4,7H,5-6H2,1H3,(H,12,13)/t7-/m0/s1