3,3-dimethyl-2,4-diphosphono-butanoic acid

Systemtic Name: 3,3-dimethyl-2,4-diphosphono-butanoic acid Openeye Name: 3,3-dimethyl-2,4-diphosphono-butanoic acid CAS Name: 3,3-dimethyl-2,4-diphosphonobutanoic acid IUPAC Name: 3,3-dimethyl-2,4-diphosphonobutanoic acid Traditional Name: 3,3-dimethyl-2,4-diphosphono-butyric acid Formula: C6H14O8P2 MolecularWeight: 276.118082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CP(=O)(O)O)C(C(=O)O)P(=O)(O)O

Isomeric SMILES

CC(C)(CP(=O)(O)O)C(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C6H14O8P2/c1-6(2,3-15(9,10)11)4(5(7)8)16(12,13)14/h4H,3H2,1-2H3,(H,7,8)(H2,9,10,11)(H2,12,13,14)