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

Systemtic Name: [1-[ethanoyl(phenethyl)amino]-3-icosoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[[acetyl(phenethyl)amino]methyl]-2-icosoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-[acetyl(phenethyl)amino]-3-eicosoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-[acetyl(phenethyl)amino]-3-icosoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[acetyl(phenethyl)amino]methyl]-2-arachyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C38H71N2O6P MolecularWeight: 682.953901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CN(CCC1=CC=CC=C1)C(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CN(CCC1=CC=CC=C1)C(=O)C)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C38H71N2O6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-32-44-35-38(46-47(42,43)45-33-31-40(3,4)5)34-39(36(2)41)30-29-37-27-24-23-25-28-37/h23-25,27-28,38H,6-22,26,29-35H2,1-5H3