[(2S)-1-methoxy-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2S)-1-methoxy-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(1S)-1-(methoxymethyl)-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2S)-1-methoxy-3-octadecoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2S)-1-methoxy-3-octadecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(1S)-1-(methoxymethyl)-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H58NO6P MolecularWeight: 523.726281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COC)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@H](COC)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C27H58NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-32-26-27(25-31-5)34-35(29,30)33-24-22-28(2,3)4/h27H,6-26H2,1-5H3/t27-/m0/s1