2-(2-dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxidanylidene-butanoyl)oxy-2-methyl-propanedioic acid

Systemtic Name: 2-(2-dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxidanylidene-butanoyl)oxy-2-methyl-propanedioic acid Openeye Name: 2-(2-dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxo-butanoyl)oxy-2-methyl-propanedioic acid CAS Name: 2-[2-(dimethoxyphosphinothioylthio)-4-ethoxy-1,4-dioxobutoxy]-2-methylpropanedioic acid IUPAC Name: 2-(2-dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoyl)oxy-2-methylpropanedioic acid Traditional Name: 2-[2-(dimethoxythiophosphorylthio)-4-ethoxy-4-keto-butanoyl]oxy-2-methyl-malonic acid Formula: C12H19O10PS2 MolecularWeight: 418.377021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)OC(C)(C(=O)O)C(=O)O)SP(=S)(OC)OC

Isomeric SMILES

CCOC(=O)CC(C(=O)OC(C)(C(=O)O)C(=O)O)SP(=S)(OC)OC

InChI

InChI=1S/C12H19O10PS2/c1-5-21-8(13)6-7(25-23(24,19-3)20-4)9(14)22-12(2,10(15)16)11(17)18/h7H,5-6H2,1-4H3,(H,15,16)(H,17,18)