1,1,1,5-tetraphosphonopentan-2-ylphosphonic acid

Systemtic Name: 1,1,1,5-tetraphosphonopentan-2-ylphosphonic acid Openeye Name: [4-phosphono-1-(triphosphonomethyl)butyl]phosphonic acid CAS Name: 1,1,1,5-tetraphosphonopentan-2-ylphosphonic acid IUPAC Name: 1,1,1,5-tetraphosphonopentan-2-ylphosphonic acid Traditional Name: [4-phosphono-1-(triphosphonomethyl)butyl]phosphonic acid Formula: C5H17O15P5 MolecularWeight: 472.048285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H17O15P5/c6-21(7,8)3-1-2-4(22(9,10)11)5(23(12,13)14,24(15,16)17)25(18,19)20/h4H,1-3H2,(H2,6,7,8)(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)