2-[[(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(E,3S)-4-hexadecoxy-3-methoxybut-1-enyl]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(E,3S)-4-hexadecoxy-3-methoxybut-1-enyl]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(E,3S)-4-cetyloxy-3-methoxy-but-1-enyl]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C26H55NO5P+ MolecularWeight: 492.692361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(C=CP(=O)(O)OCC[N+](C)(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@H](/C=C/P(=O)(O)OCC[N+](C)(C)C)OC

InChI

InChI=1S/C26H54NO5P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-31-25-26(30-5)20-24-33(28,29)32-23-21-27(2,3)4/h20,24,26H,6-19,21-23,25H2,1-5H3/p+1/b24-20+/t26-/m0/s1