[3,4-bis(oxidanyl)-4-oxidanylidene-3-phosphono-butyl]-trimethyl-azanium iodide

Systemtic Name: [3,4-bis(oxidanyl)-4-oxidanylidene-3-phosphono-butyl]-trimethyl-azanium iodide Openeye Name: (3,4-dihydroxy-4-oxo-3-phosphono-butyl)-trimethyl-ammonium iodide CAS Name: (3,4-dihydroxy-4-oxo-3-phosphonobutyl)-trimethylammonium iodide IUPAC Name: (3,4-dihydroxy-4-oxo-3-phosphonobutyl)-trimethylazanium iodide Traditional Name: (3,4-dihydroxy-4-keto-3-phosphono-butyl)-trimethyl-ammonium iodide Formula: C7H17INO6P MolecularWeight: 369.091211

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC(C(=O)O)(O)P(=O)(O)O.[I-]

Isomeric SMILES

C[N+](C)(C)CCC(C(=O)O)(O)P(=O)(O)O.[I-]

InChI

InChI=1S/C7H16NO6P.HI/c1-8(2,3)5-4-7(11,6(9)10)15(12,13)14;/h11H,4-5H2,1-3H3,(H2-,9,10,12,13,14);1H