2-[6-[2-(4-butoxyphenyl)ethanoylamino]hexanoyloxy]ethyl-trimethyl-azanium iodide

Systemtic Name: 2-[6-[2-(4-butoxyphenyl)ethanoylamino]hexanoyloxy]ethyl-trimethyl-azanium iodide Openeye Name: 2-[6-[[2-(4-butoxyphenyl)acetyl]amino]hexanoyloxy]ethyl-trimethyl-ammonium iodide CAS Name: 2-[6-[[2-(4-butoxyphenyl)-1-oxoethyl]amino]-1-oxohexoxy]ethyl-trimethylammonium iodide IUPAC Name: 2-[6-[[2-(4-butoxyphenyl)acetyl]amino]hexanoyloxy]ethyl-trimethylazanium iodide Traditional Name: 2-[6-[[2-(4-butoxyphenyl)acetyl]amino]hexanoyloxy]ethyl-trimethyl-ammonium iodide Formula: C23H39IN2O4 MolecularWeight: 534.47123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC(=O)NCCCCCC(=O)OCC[N+](C)(C)C.[I-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC(=O)NCCCCCC(=O)OCC[N+](C)(C)C.[I-]

InChI

InChI=1S/C23H38N2O4.HI/c1-5-6-17-28-21-13-11-20(12-14-21)19-22(26)24-15-9-7-8-10-23(27)29-18-16-25(2,3)4;/h11-14H,5-10,15-19H2,1-4H3;1H