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

Systemtic Name: 3-methyl-2,4-diphosphono-butanoic acid Openeye Name: 3-methyl-2,4-diphosphono-butanoic acid CAS Name: 3-methyl-2,4-diphosphonobutanoic acid IUPAC Name: 3-methyl-2,4-diphosphonobutanoic acid Traditional Name: 3-methyl-2,4-diphosphono-butyric acid Formula: C5H12O8P2 MolecularWeight: 262.091502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H12O8P2/c1-3(2-14(8,9)10)4(5(6)7)15(11,12)13/h3-4H,2H2,1H3,(H,6,7)(H2,8,9,10)(H2,11,12,13)