2-[[2-methoxy-3-(3-tridecylphenoxy)propoxy]-oxidanyl-phosphoryl]ethyl-trimethyl-azanium

Systemtic Name: 2-[[2-methoxy-3-(3-tridecylphenoxy)propoxy]-oxidanyl-phosphoryl]ethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[2-methoxy-3-(3-tridecylphenoxy)propoxy]phosphoryl]ethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-methoxy-3-(3-tridecylphenoxy)propoxy]phosphoryl]ethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-methoxy-3-(3-tridecylphenoxy)propoxy]phosphoryl]ethyl-trimethylazanium Traditional Name: 2-[hydroxy-[2-methoxy-3-(3-tridecylphenoxy)propoxy]phosphoryl]ethyl-trimethyl-ammonium Formula: C28H53NO5P+ MolecularWeight: 514.697881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(=O)(CC[N+](C)(C)C)O)OC

Isomeric SMILES

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(=O)(CC[N+](C)(C)C)O)OC

InChI

InChI=1S/C28H52NO5P/c1-6-7-8-9-10-11-12-13-14-15-16-18-26-19-17-20-27(23-26)33-24-28(32-5)25-34-35(30,31)22-21-29(2,3)4/h17,19-20,23,28H,6-16,18,21-22,24-25H2,1-5H3/p+1