[1-[[8-(2-azanylphenoxy)-2-oxidanyl-octoxy]-oxidanylidene-phosphaniumyl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide

Systemtic Name: [1-[[8-(2-azanylphenoxy)-2-oxidanyl-octoxy]-oxidanylidene-phosphaniumyl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide Openeye Name: [1-[[8-(2-aminophenoxy)-2-hydroxy-octoxy]-oxo-phosphaniumyl]oxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium hydroxide CAS Name: [1-[[8-(2-aminophenoxy)-2-hydroxyoctoxy]-oxophosphiniumyl]oxy-4-hydroxy-4-oxobutyl]-trimethylammonium hydroxide IUPAC Name: [1-[[8-(2-aminophenoxy)-2-hydroxyoctoxy]-oxophosphaniumyl]oxy-4-hydroxy-4-oxobutyl]-trimethylazanium hydroxide Traditional Name: [1-[[8-(2-aminophenoxy)-2-hydroxy-octoxy]-keto-phosphiniumyl]oxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium hydroxide Formula: C21H38N2O8P+ MolecularWeight: 477.508781

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CCC(=O)O)O[P+](=O)OCC(CCCCCCOC1=CC=CC=C1N)O.[OH-]

Isomeric SMILES

C[N+](C)(C)C(CCC(=O)O)O[P+](=O)OCC(CCCCCCOC1=CC=CC=C1N)O.[OH-]

InChI

InChI=1S/C21H36N2O7P.H2O/c1-23(2,3)20(13-14-21(25)26)30-31(27)29-16-17(24)10-6-4-5-9-15-28-19-12-8-7-11-18(19)22;/h7-8,11-12,17,20,24H,4-6,9-10,13-16,22H2,1-3H3;1H2/q+1;