[1-icosoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-icosoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[(benzylamino)methyl]-2-icosoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-eicosoxy-3-[(phenylmethyl)amino]propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-(benzylamino)-3-icosoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(arachyloxymethyl)-2-(benzylamino)ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C35H67N2O5P MolecularWeight: 626.890641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CNCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CNCC1=CC=CC=C1)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C35H67N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-29-40-33-35(32-36-31-34-26-23-22-24-27-34)42-43(38,39)41-30-28-37(2,3)4/h22-24,26-27,35-36H,5-21,25,28-33H2,1-4H3