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

Systemtic Name: [2-[1-docosoxy-3-[2-(trimethylazaniumyl)ethanoyloxy]propan-2-yl]oxy-2-oxidanylidene-ethyl]-trimethyl-azanium Openeye Name: [2-[1-(docosoxymethyl)-2-[2-(trimethylammonio)acetyl]oxy-ethoxy]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [2-[1-docosoxy-3-[1-oxo-2-(trimethylammonio)ethoxy]propan-2-yl]oxy-2-oxoethyl]-trimethylammonium IUPAC Name: [2-[1-docosoxy-3-[2-(trimethylazaniumyl)acetyl]oxypropan-2-yl]oxy-2-oxoethyl]-trimethylazanium Traditional Name: [2-[1-(behenyloxymethyl)-2-[2-(trimethylammonio)acetyl]oxy-ethoxy]-2-keto-ethyl]-trimethyl-ammonium Formula: C35H72N2O5+2 MolecularWeight: 600.95658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H72N2O5/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-40-31-33(42-35(39)30-37(5,6)7)32-41-34(38)29-36(2,3)4/h33H,8-32H2,1-7H3/q+2