3-[[2-acetyloxy-3-(3-tridecoxyphenyl)propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium hydroxide

Systemtic Name: 3-[[2-acetyloxy-3-(3-tridecoxyphenyl)propoxy]-oxidanyl-phosphoryl]propyl-trimethyl-azanium hydroxide Openeye Name: 3-[[2-acetoxy-3-(3-tridecoxyphenyl)propoxy]-hydroxy-phosphoryl]propyl-trimethyl-ammonium hydroxide CAS Name: 3-[[2-acetyloxy-3-(3-tridecoxyphenyl)propoxy]-hydroxyphosphoryl]propyl-trimethylammonium hydroxide IUPAC Name: 3-[[2-acetyloxy-3-(3-tridecoxyphenyl)propoxy]-hydroxyphosphoryl]propyl-trimethylazanium hydroxide Traditional Name: 3-[[2-acetoxy-3-(3-tridecoxyphenyl)propoxy]-hydroxy-phosphoryl]propyl-trimethyl-ammonium hydroxide Formula: C30H56NO7P MolecularWeight: 573.741901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC1=CC=CC(=C1)CC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C.[OH-]

Isomeric SMILES

CCCCCCCCCCCCCOC1=CC=CC(=C1)CC(COP(=O)(CCC[N+](C)(C)C)O)OC(=O)C.[OH-]

InChI

InChI=1S/C30H54NO6P.H2O/c1-6-7-8-9-10-11-12-13-14-15-16-22-35-29-20-17-19-28(24-29)25-30(37-27(2)32)26-36-38(33,34)23-18-21-31(3,4)5;/h17,19-20,24,30H,6-16,18,21-23,25-26H2,1-5H3;1H2