[2-[1-hexadecoxy-3-[2-(trimethylazaniumyl)ethanoyloxy]propan-2-yl]oxy-2-oxidanylidene-ethyl]-trimethyl-azanium

Systemtic Name: [2-[1-hexadecoxy-3-[2-(trimethylazaniumyl)ethanoyloxy]propan-2-yl]oxy-2-oxidanylidene-ethyl]-trimethyl-azanium Openeye Name: [2-[1-(hexadecoxymethyl)-2-[2-(trimethylammonio)acetyl]oxy-ethoxy]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [2-[1-hexadecoxy-3-[1-oxo-2-(trimethylammonio)ethoxy]propan-2-yl]oxy-2-oxoethyl]-trimethylammonium IUPAC Name: [2-[1-hexadecoxy-3-[2-(trimethylazaniumyl)acetyl]oxypropan-2-yl]oxy-2-oxoethyl]-trimethylazanium Traditional Name: [2-[1-(cetyloxymethyl)-2-[2-(trimethylammonio)acetyl]oxy-ethoxy]-2-keto-ethyl]-trimethyl-ammonium Formula: C29H60N2O5+2 MolecularWeight: 516.7971

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COC(=O)C[N+](C)(C)C)OC(=O)C[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COC(=O)C[N+](C)(C)C)OC(=O)C[N+](C)(C)C

InChI

InChI=1S/C29H60N2O5/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-34-25-27(36-29(33)24-31(5,6)7)26-35-28(32)23-30(2,3)4/h27H,8-26H2,1-7H3/q+2