[(2-methylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid

Systemtic Name: [(2-methylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Openeye Name: [(2-methylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid CAS Name: [(2-methyl-4-thiomorpholinyl)-phosphonomethyl]phosphonic acid IUPAC Name: [(2-methylthiomorpholin-4-yl)-phosphonomethyl]phosphonic acid Traditional Name: [(2-methylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Formula: C6H15NO6P2S MolecularWeight: 291.198922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCS1)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1CN(CCS1)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H15NO6P2S/c1-5-4-7(2-3-16-5)6(14(8,9)10)15(11,12)13/h5-6H,2-4H2,1H3,(H2,8,9,10)(H2,11,12,13)