[(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-[2-(trimethylazaniumyl)ethoxy]phosphinate

Systemtic Name: [(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-[2-(trimethylazaniumyl)ethoxy]phosphinate Openeye Name: [(E,3S)-4-hexadecoxy-3-methoxy-but-1-enyl]-[2-(trimethylammonio)ethoxy]phosphinate CAS Name: [(E,3S)-4-hexadecoxy-3-methoxybut-1-enyl]-[2-(trimethylammonio)ethoxy]phosphinate IUPAC Name: [(E,3S)-4-hexadecoxy-3-methoxybut-1-enyl]-[2-(trimethylazaniumyl)ethoxy]phosphinate Traditional Name: [(E,3S)-4-cetyloxy-3-methoxy-but-1-enyl]-[2-(trimethylammonio)ethoxy]phosphinate Formula: C26H54NO5P MolecularWeight: 491.684421

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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/b24-20+/t26-/m0/s1