[1-(ethoxycarbonylamino)-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-(ethoxycarbonylamino)-3-octadecoxy-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-[(ethoxycarbonylamino)methyl]-2-octadecoxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-(ethoxycarbonylamino)-3-octadecoxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-(ethoxycarbonylamino)-3-octadecoxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-[(carbethoxyamino)methyl]-2-stearyloxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C29H61N2O7P MolecularWeight: 580.777601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H61N2O7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-35-27-28(26-30-29(32)36-7-2)38-39(33,34)37-25-23-31(3,4)5/h28H,6-27H2,1-5H3,(H-,30,32,33,34)