(4R,6S)-6-[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylmethyl]-4-oxidanyl-oxan-2-one

Systemtic Name: (4R,6S)-6-[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylmethyl]-4-oxidanyl-oxan-2-one Openeye Name: (4R,6S)-6-[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylmethyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: (4R,6S)-6-[[(3,5-ditert-butyl-4-hydroxyphenyl)thio]methyl]-4-hydroxy-2-oxanone IUPAC Name: (4R,6S)-6-[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylmethyl]-4-hydroxyoxan-2-one Traditional Name: (4R,6S)-6-[[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]methyl]-4-hydroxy-tetrahydropyran-2-one Formula: C20H30O4S MolecularWeight: 366.5148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC2CC(CC(=O)O2)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC[C@@H]2C[C@H](CC(=O)O2)O

InChI

InChI=1S/C20H30O4S/c1-19(2,3)15-9-14(10-16(18(15)23)20(4,5)6)25-11-13-7-12(21)8-17(22)24-13/h9-10,12-13,21,23H,7-8,11H2,1-6H3/t12-,13+/m1/s1