[1-octadecoxy-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-octadecoxy-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[[(2-benzyloxy-2-oxo-ethyl)amino]methyl]-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-octadecoxy-3-[(2-oxo-2-phenylmethoxyethyl)amino]propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-octadecoxy-3-[(2-oxo-2-phenylmethoxyethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[(2-benzoxy-2-keto-ethyl)amino]methyl]-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C35H65N2O7P MolecularWeight: 656.873561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CNCC(=O)OCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CNCC(=O)OCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C35H65N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-41-32-34(44-45(39,40)43-28-26-37(2,3)4)29-36-30-35(38)42-31-33-24-21-20-22-25-33/h20-22,24-25,34,36H,5-19,23,26-32H2,1-4H3