3-(4-ethanoyl-2,5-dimethyl-phenyl)sulfanyl-2,2-dimethyl-propanoic acid

Systemtic Name: 3-(4-ethanoyl-2,5-dimethyl-phenyl)sulfanyl-2,2-dimethyl-propanoic acid Openeye Name: 3-(4-acetyl-2,5-dimethyl-phenyl)sulfanyl-2,2-dimethyl-propanoic acid CAS Name: 3-[(4-acetyl-2,5-dimethylphenyl)thio]-2,2-dimethylpropanoic acid IUPAC Name: 3-(4-acetyl-2,5-dimethylphenyl)sulfanyl-2,2-dimethylpropanoic acid Traditional Name: 3-[(4-acetyl-2,5-dimethyl-phenyl)thio]-2,2-dimethyl-propionic acid Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C)C)SCC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C)C)SCC(C)(C)C(=O)O

InChI

InChI=1S/C15H20O3S/c1-9-7-13(10(2)6-12(9)11(3)16)19-8-15(4,5)14(17)18/h6-7H,8H2,1-5H3,(H,17,18)