[4-(2-acetyloxy-3-octadecoxy-propoxy)-4-oxidanylidene-butyl]-trimethyl-azanium iodide

Systemtic Name: [4-(2-acetyloxy-3-octadecoxy-propoxy)-4-oxidanylidene-butyl]-trimethyl-azanium iodide Openeye Name: [4-(2-acetoxy-3-octadecoxy-propoxy)-4-oxo-butyl]-trimethyl-ammonium iodide CAS Name: [4-(2-acetyloxy-3-octadecoxypropoxy)-4-oxobutyl]-trimethylammonium iodide IUPAC Name: [4-(2-acetyloxy-3-octadecoxypropoxy)-4-oxobutyl]-trimethylazanium iodide Traditional Name: [4-(2-acetoxy-3-stearyloxy-propoxy)-4-keto-butyl]-trimethyl-ammonium iodide Formula: C30H60INO5 MolecularWeight: 641.70557

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COC(=O)CCC[N+](C)(C)C)OC(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COC(=O)CCC[N+](C)(C)C)OC(=O)C.[I-]

InChI

InChI=1S/C30H60NO5.HI/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-34-26-29(36-28(2)32)27-35-30(33)23-22-24-31(3,4)5;/h29H,6-27H2,1-5H3;1H/q+1;/p-1