(2-ethoxycarbonyloxy-3-hexadecoxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (2-ethoxycarbonyloxy-3-hexadecoxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-ethoxycarbonyloxy-3-hexadecoxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: (2-ethoxycarbonyloxy-3-hexadecoxypropyl) 2-(trimethylammonio)ethyl phosphate IUPAC Name: (2-ethoxycarbonyloxy-3-hexadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-carbethoxyoxy-3-cetyloxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C27H56NO8P MolecularWeight: 553.709201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H56NO8P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-24-26(36-27(29)33-7-2)25-35-37(30,31)34-23-21-28(3,4)5/h26H,6-25H2,1-5H3