3-[[5-(ethoxymethyl)-1-benzofuran-2-yl]carbonyloxy]butyl-trimethyl-azanium iodide

Systemtic Name: 3-[[5-(ethoxymethyl)-1-benzofuran-2-yl]carbonyloxy]butyl-trimethyl-azanium iodide Openeye Name: 3-[5-(ethoxymethyl)benzofuran-2-carbonyl]oxybutyl-trimethyl-ammonium iodide CAS Name: 3-[[5-(ethoxymethyl)-2-benzofuranyl]-oxomethoxy]butyl-trimethylammonium iodide IUPAC Name: 3-[5-(ethoxymethyl)-1-benzofuran-2-carbonyl]oxybutyl-trimethylazanium iodide Traditional Name: 3-[5-(ethoxymethyl)benzofuran-2-carbonyl]oxybutyl-trimethyl-ammonium iodide Formula: C19H28INO4 MolecularWeight: 461.33439

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC2=C(C=C1)OC(=C2)C(=O)OC(C)CC[N+](C)(C)C.[I-]

Isomeric SMILES

CCOCC1=CC2=C(C=C1)OC(=C2)C(=O)OC(C)CC[N+](C)(C)C.[I-]

InChI

InChI=1S/C19H28NO4.HI/c1-6-22-13-15-7-8-17-16(11-15)12-18(24-17)19(21)23-14(2)9-10-20(3,4)5;/h7-8,11-12,14H,6,9-10,13H2,1-5H3;1H/q+1;/p-1