2-[(3,3-dimethyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)oxy-sulfanyl-phosphinothioyl]oxy-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(3,3-dimethyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)oxy-sulfanyl-phosphinothioyl]oxy-3,3-dimethyl-butanoic acid Openeye Name: 2-[(1-carboxy-2,2-dimethyl-propoxy)-sulfanyl-phosphinothioyl]oxy-3,3-dimethyl-butanoic acid CAS Name: 2-[(1-hydroxy-3,3-dimethyl-1-oxobutan-2-yl)oxy-mercaptophosphinothioyl]oxy-3,3-dimethylbutanoic acid IUPAC Name: 2-[(1-hydroxy-3,3-dimethyl-1-oxobutan-2-yl)oxy-sulfanylphosphinothioyl]oxy-3,3-dimethylbutanoic acid Traditional Name: 2-[(1-carboxy-2,2-dimethyl-propoxy)-mercapto-thiophosphoryl]oxy-3,3-dimethyl-butyric acid Formula: C12H23O6PS2 MolecularWeight: 358.411181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)OP(=S)(OC(C(=O)O)C(C)(C)C)S

Isomeric SMILES

CC(C)(C)C(C(=O)O)OP(=S)(OC(C(=O)O)C(C)(C)C)S

InChI

InChI=1S/C12H23O6PS2/c1-11(2,3)7(9(13)14)17-19(20,21)18-8(10(15)16)12(4,5)6/h7-8H,1-6H3,(H,13,14)(H,15,16)(H,20,21)