4-bromanyl-2,4-diphosphono-butanoic acid

Systemtic Name: 4-bromanyl-2,4-diphosphono-butanoic acid Openeye Name: 4-bromo-2,4-diphosphono-butanoic acid CAS Name: 4-bromo-2,4-diphosphonobutanoic acid IUPAC Name: 4-bromo-2,4-diphosphonobutanoic acid Traditional Name: 4-bromo-2,4-diphosphono-butyric acid Formula: C4H9BrO8P2 MolecularWeight: 326.960982

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)P(=O)(O)O)C(P(=O)(O)O)Br

Isomeric SMILES

C(C(C(=O)O)P(=O)(O)O)C(P(=O)(O)O)Br

InChI

InChI=1S/C4H9BrO8P2/c5-3(15(11,12)13)1-2(4(6)7)14(8,9)10/h2-3H,1H2,(H,6,7)(H2,8,9,10)(H2,11,12,13)