2-[(3,5-ditert-butylphenyl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3,5-ditert-butylphenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3,5-ditert-butylphenyl)methylsulfanyl]acetic acid CAS Name: 2-[(3,5-ditert-butylphenyl)methylthio]acetic acid IUPAC Name: 2-[(3,5-ditert-butylphenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(3,5-ditert-butylbenzyl)thio]acetic acid Formula: C17H26O2S MolecularWeight: 294.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CSCC(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CSCC(=O)O)C(C)(C)C

InChI

InChI=1S/C17H26O2S/c1-16(2,3)13-7-12(10-20-11-15(18)19)8-14(9-13)17(4,5)6/h7-9H,10-11H2,1-6H3,(H,18,19)