[1-[methyl(methylcarbamoyl)amino]-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-[methyl(methylcarbamoyl)amino]-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[[methyl(methylcarbamoyl)amino]methyl]-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-[methyl(methylcarbamoyl)amino]-3-octadecoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-[methyl(methylcarbamoyl)amino]-3-octadecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[[methyl(methylcarbamoyl)amino]methyl]-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C29H62N3O6P MolecularWeight: 579.792841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CN(C)C(=O)NC)OP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CN(C)C(=O)NC)OP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C29H62N3O6P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-36-27-28(26-31(3)29(33)30-2)38-39(34,35)37-25-23-32(4,5)6/h28H,7-27H2,1-6H3,(H-,30,33,34,35)