2-[[(E,3S)-5-hexadecoxy-3-(methoxymethyl)-3-methyl-pent-1-enoxy]-oxidanyl-phosphoryl]ethyl-trimethyl-azanium

Systemtic Name: 2-[[(E,3S)-5-hexadecoxy-3-(methoxymethyl)-3-methyl-pent-1-enoxy]-oxidanyl-phosphoryl]ethyl-trimethyl-azanium Openeye Name: 2-[[(E,3S)-5-hexadecoxy-3-(methoxymethyl)-3-methyl-pent-1-enoxy]-hydroxy-phosphoryl]ethyl-trimethyl-ammonium CAS Name: 2-[[(E,3S)-5-hexadecoxy-3-(methoxymethyl)-3-methylpent-1-enoxy]-hydroxyphosphoryl]ethyl-trimethylammonium IUPAC Name: 2-[[(E,3S)-5-hexadecoxy-3-(methoxymethyl)-3-methylpent-1-enoxy]-hydroxyphosphoryl]ethyl-trimethylazanium Traditional Name: 2-[[(E,3S)-5-cetyloxy-3-(methoxymethyl)-3-methyl-pent-1-enoxy]-hydroxy-phosphoryl]ethyl-trimethyl-ammonium Formula: C29H61NO5P+ MolecularWeight: 534.772101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCC(C)(COC)C=COP(=O)(CC[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC[C@](C)(COC)/C=C/OP(=O)(CC[N+](C)(C)C)O

InChI

InChI=1S/C29H60NO5P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-34-25-21-29(2,28-33-6)22-26-35-36(31,32)27-23-30(3,4)5/h22,26H,7-21,23-25,27-28H2,1-6H3/p+1/b26-22+/t29-/m0/s1