(2S)-2-(tert-butylsulfanylmethyl)-2-methyl-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid

Systemtic Name: (2S)-2-(tert-butylsulfanylmethyl)-2-methyl-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid Openeye Name: (2S)-3-tert-butoxy-2-(tert-butylsulfanylmethyl)-2-methyl-3-oxo-propanoic acid CAS Name: (2S)-2-[(tert-butylthio)methyl]-2-methyl-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid IUPAC Name: (2S)-2-(tert-butylsulfanylmethyl)-2-methyl-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid Traditional Name: (2S)-3-tert-butoxy-2-[(tert-butylthio)methyl]-3-keto-2-methyl-propionic acid Formula: C13H24O4S MolecularWeight: 276.39226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C)(CSC(C)(C)C)C(=O)O

Isomeric SMILES

C[C@](CSC(C)(C)C)(C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H24O4S/c1-11(2,3)17-10(16)13(7,9(14)15)8-18-12(4,5)6/h8H2,1-7H3,(H,14,15)/t13-/m0/s1