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

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]acetic acid CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]acetic acid IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]acetic acid Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSCC(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSCC(=O)O)C)C(C)(C)C

InChI

InChI=1S/C15H22O2S/c1-10-6-12(15(3,4)5)7-11(2)13(10)8-18-9-14(16)17/h6-7H,8-9H2,1-5H3,(H,16,17)