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

Systemtic Name: [(2S)-3-hexadecoxy-2-prop-2-enoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2S)-3-hexadecoxy-2-prop-2-enoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2S)-3-hexadecoxy-2-(1-oxoprop-2-enoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2S)-3-hexadecoxy-2-prop-2-enoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2S)-2-acryloyloxy-3-cetyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H54NO7P MolecularWeight: 535.693921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C=C

InChI

InChI=1S/C27H54NO7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-24-26(35-27(29)7-2)25-34-36(30,31)33-23-21-28(3,4)5/h7,26H,2,6,8-25H2,1,3-5H3/t26-/m0/s1