tert-butyl 2-[(2S,3R)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutan-2-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[(2S,3R)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutan-2-yl]oxyethanoate Openeye Name: tert-butyl 2-[(1S,2R)-2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-propoxy]acetate CAS Name: 2-[(2S,3R)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]butan-2-yl]oxyacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S,3R)-3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylbutan-2-yl]oxyacetate Traditional Name: 2-[(1S,2R)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-methyl-propoxy]acetic acid tert-butyl ester Formula: C24H40O4S MolecularWeight: 424.637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]([C@@H](C)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OCC(=O)OC(C)(C)C

InChI

InChI=1S/C24H40O4S/c1-15(27-14-20(25)28-24(9,10)11)16(2)29-17-12-18(22(3,4)5)21(26)19(13-17)23(6,7)8/h12-13,15-16,26H,14H2,1-11H3/t15-,16+/m0/s1