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

Systemtic Name: [1-hexadecoxy-3-[methyl(methylcarbamoyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(hexadecoxymethyl)-2-[methyl(methylcarbamoyl)amino]ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-hexadecoxy-3-[methyl(methylcarbamoyl)amino]propan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-hexadecoxy-3-[methyl(methylcarbamoyl)amino]propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(cetyloxymethyl)-2-[methyl(methylcarbamoyl)amino]ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H58N3O6P MolecularWeight: 551.739681

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H58N3O6P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-34-25-26(24-29(3)27(31)28-2)36-37(32,33)35-23-21-30(4,5)6/h26H,7-25H2,1-6H3,(H-,28,31,32,33)