[2-[8-(3-fluoranyl-4-nitro-phenoxy)octoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide

Systemtic Name: [2-[8-(3-fluoranyl-4-nitro-phenoxy)octoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide Openeye Name: [2-[8-(3-fluoro-4-nitro-phenoxy)octoxy-hydroxy-phosphoryl]oxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium hydroxide CAS Name: [2-[8-(3-fluoro-4-nitrophenoxy)octoxy-hydroxyphosphoryl]oxy-4-hydroxy-4-oxobutyl]-trimethylammonium hydroxide IUPAC Name: [2-[8-(3-fluoro-4-nitrophenoxy)octoxy-hydroxyphosphoryl]oxy-4-hydroxy-4-oxobutyl]-trimethylazanium hydroxide Traditional Name: [2-[8-(3-fluoro-4-nitro-phenoxy)octoxy-hydroxy-phosphoryl]oxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium hydroxide Formula: C21H36FN2O10P MolecularWeight: 526.490104

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])F.[OH-]

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])F.[OH-]

InChI

InChI=1S/C21H34FN2O9P.H2O/c1-24(2,3)16-18(15-21(25)26)33-34(29,30)32-13-9-7-5-4-6-8-12-31-17-10-11-20(23(27)28)19(22)14-17;/h10-11,14,18H,4-9,12-13,15-16H2,1-3H3,(H-,25,26,29,30);1H2