(5-chloranyl-1-fluoranyl-4-methyl-4-oxidanyl-1-phosphono-pentyl)phosphonic acid

Systemtic Name: (5-chloranyl-1-fluoranyl-4-methyl-4-oxidanyl-1-phosphono-pentyl)phosphonic acid Openeye Name: (5-chloro-1-fluoro-4-hydroxy-4-methyl-1-phosphono-pentyl)phosphonic acid CAS Name: (5-chloro-1-fluoro-4-hydroxy-4-methyl-1-phosphonopentyl)phosphonic acid IUPAC Name: (5-chloro-1-fluoro-4-hydroxy-4-methyl-1-phosphonopentyl)phosphonic acid Traditional Name: (5-chloro-1-fluoro-4-hydroxy-4-methyl-1-phosphono-pentyl)phosphonic acid Formula: C6H14ClFO7P2 MolecularWeight: 314.570085

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(F)(P(=O)(O)O)P(=O)(O)O)(CCl)O

Isomeric SMILES

CC(CCC(F)(P(=O)(O)O)P(=O)(O)O)(CCl)O

InChI

InChI=1S/C6H14ClFO7P2/c1-5(9,4-7)2-3-6(8,16(10,11)12)17(13,14)15/h9H,2-4H2,1H3,(H2,10,11,12)(H2,13,14,15)