(1-oxidanyl-1-phosphono-butyl)phosphonic acid; sodium

Systemtic Name: (1-oxidanyl-1-phosphono-butyl)phosphonic acid; sodium Openeye Name: (1-hydroxy-1-phosphono-butyl)phosphonic acid; sodium CAS Name: (1-hydroxy-1-phosphonobutyl)phosphonic acid; sodium IUPAC Name: (1-hydroxy-1-phosphonobutyl)phosphonic acid; sodium Traditional Name: (1-hydroxy-1-phosphono-butyl)phosphonic acid; sodium Formula: C4H12NaO7P2 MolecularWeight: 257.071172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)(P(=O)(O)O)P(=O)(O)O.[Na]

Isomeric SMILES

CCCC(O)(P(=O)(O)O)P(=O)(O)O.[Na]

InChI

InChI=1S/C4H12O7P2.Na/c1-2-3-4(5,12(6,7)8)13(9,10)11;/h5H,2-3H2,1H3,(H2,6,7,8)(H2,9,10,11);