5-methylsulfanyl-1-phosphorosooxy-pentane-2,3-dione

Systemtic Name: 5-methylsulfanyl-1-phosphorosooxy-pentane-2,3-dione Openeye Name: 5-methylsulfanyl-1-phosphorosooxy-pentane-2,3-dione CAS Name: 5-(methylthio)-1-phosphorosooxypentane-2,3-dione IUPAC Name: 5-methylsulfanyl-1-phosphorosooxypentane-2,3-dione Traditional Name: 5-(methylthio)-1-phosphorosooxy-pentane-2,3-dione Formula: C6H9O4PS MolecularWeight: 208.172021

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)C(=O)COP=O

Isomeric SMILES

CSCCC(=O)C(=O)COP=O

InChI

InChI=1S/C6H9O4PS/c1-12-3-2-5(7)6(8)4-10-11-9/h2-4H2,1H3