(1-octadecoxy-3-phenylazanyl-propan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (1-octadecoxy-3-phenylazanyl-propan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(anilinomethyl)-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: (1-anilino-3-octadecoxypropan-2-yl) 2-(trimethylammonio)ethyl phosphate IUPAC Name: (1-anilino-3-octadecoxypropan-2-yl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(anilinomethyl)-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C32H61N2O5P MolecularWeight: 584.810901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CNC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CNC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C32H61N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-37-30-32(29-33-31-24-21-20-22-25-31)39-40(35,36)38-28-26-34(2,3)4/h20-22,24-25,32-33H,5-19,23,26-30H2,1-4H3