3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]propanoic acid Openeye Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]propanoic acid CAS Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]propanoic acid IUPAC Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]propanoic acid Traditional Name: 3-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]propionic acid Formula: C16H24O2S MolecularWeight: 280.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSCCC(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSCCC(=O)O)C)C(C)(C)C

InChI

InChI=1S/C16H24O2S/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-19-7-6-15(17)18/h8-9H,6-7,10H2,1-5H3,(H,17,18)