(3-oxidanyl-1-phosphono-butan-2-yl)phosphonic acid

Systemtic Name: (3-oxidanyl-1-phosphono-butan-2-yl)phosphonic acid Openeye Name: (3-hydroxy-2-phosphono-butyl)phosphonic acid CAS Name: (3-hydroxy-1-phosphonobutan-2-yl)phosphonic acid IUPAC Name: (3-hydroxy-1-phosphonobutan-2-yl)phosphonic acid Traditional Name: (3-hydroxy-2-phosphono-butyl)phosphonic acid Formula: C4H12O7P2 MolecularWeight: 234.081402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H12O7P2/c1-3(5)4(13(9,10)11)2-12(6,7)8/h3-5H,2H2,1H3,(H2,6,7,8)(H2,9,10,11)