(4-methoxy-2-phosphono-butan-2-yl)phosphonic acid

Systemtic Name: (4-methoxy-2-phosphono-butan-2-yl)phosphonic acid Openeye Name: (3-methoxy-1-methyl-1-phosphono-propyl)phosphonic acid CAS Name: (4-methoxy-2-phosphonobutan-2-yl)phosphonic acid IUPAC Name: (4-methoxy-2-phosphonobutan-2-yl)phosphonic acid Traditional Name: (3-methoxy-1-methyl-1-phosphono-propyl)phosphonic acid Formula: C5H14O7P2 MolecularWeight: 248.107982

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CCOC)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H14O7P2/c1-5(3-4-12-2,13(6,7)8)14(9,10)11/h3-4H2,1-2H3,(H2,6,7,8)(H2,9,10,11)