2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpropanoic acid CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propanoic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropanoic acid Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]propionic acid Formula: C17H26O3S MolecularWeight: 310.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O3S/c1-10(15(19)20)21-11-8-12(16(2,3)4)14(18)13(9-11)17(5,6)7/h8-10,18H,1-7H3,(H,19,20)