2-(dimethylazaniumyl)ethyl [1-[ethanoyl(methyl)amino]-3-hexadecoxy-propan-2-yl] phosphate

Systemtic Name: 2-(dimethylazaniumyl)ethyl [1-[ethanoyl(methyl)amino]-3-hexadecoxy-propan-2-yl] phosphate Openeye Name: [1-[[acetyl(methyl)amino]methyl]-2-hexadecoxy-ethyl] 2-(dimethylammonio)ethyl phosphate CAS Name: [1-[acetyl(methyl)amino]-3-hexadecoxypropan-2-yl] 2-(dimethylammonio)ethyl phosphate IUPAC Name: [1-[acetyl(methyl)amino]-3-hexadecoxypropan-2-yl] 2-(dimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[acetyl(methyl)amino]methyl]-2-cetyloxy-ethyl] 2-(dimethylammonio)ethyl phosphate Formula: C26H55N2O6P MolecularWeight: 522.698461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN(C)C(=O)C)OP(=O)([O-])OCC[NH+](C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN(C)C(=O)C)OP(=O)([O-])OCC[NH+](C)C

InChI

InChI=1S/C26H55N2O6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-32-24-26(23-28(5)25(2)29)34-35(30,31)33-22-20-27(3)4/h26H,6-24H2,1-5H3,(H,30,31)