2-(3,5-ditert-butylphenyl)sulfanylpropanoic acid

Systemtic Name: 2-(3,5-ditert-butylphenyl)sulfanylpropanoic acid Openeye Name: 2-(3,5-ditert-butylphenyl)sulfanylpropanoic acid CAS Name: 2-[(3,5-ditert-butylphenyl)thio]propanoic acid IUPAC Name: 2-(3,5-ditert-butylphenyl)sulfanylpropanoic acid Traditional Name: 2-[(3,5-ditert-butylphenyl)thio]propionic acid Formula: C17H26O2S MolecularWeight: 294.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C(=O)O)SC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C17H26O2S/c1-11(15(18)19)20-14-9-12(16(2,3)4)8-13(10-14)17(5,6)7/h8-11H,1-7H3,(H,18,19)