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

Systemtic Name: [3-(2-acetyloxy-3-octadecoxy-propoxy)-3-oxidanylidene-propyl]-trimethyl-azanium iodide Openeye Name: [3-(2-acetoxy-3-octadecoxy-propoxy)-3-oxo-propyl]-trimethyl-ammonium iodide CAS Name: [3-(2-acetyloxy-3-octadecoxypropoxy)-3-oxopropyl]-trimethylammonium iodide IUPAC Name: [3-(2-acetyloxy-3-octadecoxypropoxy)-3-oxopropyl]-trimethylazanium iodide Traditional Name: [3-(2-acetoxy-3-stearyloxy-propoxy)-3-keto-propyl]-trimethyl-ammonium iodide Formula: C29H58INO5 MolecularWeight: 627.67899

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H58NO5.HI/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-33-25-28(35-27(2)31)26-34-29(32)22-23-30(3,4)5;/h28H,6-26H2,1-5H3;1H/q+1;/p-1