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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethanoate Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylacetate CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]acetate IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylacetate Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]acetate Formula: C16H23O3S- MolecularWeight: 295.41702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC(=O)[O-]

InChI

InChI=1S/C16H24O3S/c1-15(2,3)11-7-10(20-9-13(17)18)8-12(14(11)19)16(4,5)6/h7-8,19H,9H2,1-6H3,(H,17,18)/p-1