[(2S)-3-hexadecoxy-2-phenylmethoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2S)-3-hexadecoxy-2-phenylmethoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2S)-2-benzyloxy-3-hexadecoxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2S)-3-hexadecoxy-2-phenylmethoxypropyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2S)-3-hexadecoxy-2-phenylmethoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2S)-2-benzoxy-3-cetyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C31H58NO6P MolecularWeight: 571.769081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C31H58NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-35-28-31(36-27-30-22-19-18-20-23-30)29-38-39(33,34)37-26-24-32(2,3)4/h18-20,22-23,31H,5-17,21,24-29H2,1-4H3/t31-/m0/s1