2-hydroxyethyl(trimethyl)azanium; 2-(1-oxidanylcyclopentyl)-2-phenyl-ethanoate; hydroiodide

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; 2-(1-oxidanylcyclopentyl)-2-phenyl-ethanoate; hydroiodide Openeye Name: 2-(1-hydroxycyclopentyl)-2-phenyl-acetate; 2-hydroxyethyl(trimethyl)ammonium; hydroiodide CAS Name: 2-(1-hydroxycyclopentyl)-2-phenylacetate; 2-hydroxyethyl(trimethyl)ammonium; hydroiodide IUPAC Name: 2-(1-hydroxycyclopentyl)-2-phenylacetate; 2-hydroxyethyl(trimethyl)azanium; hydroiodide Traditional Name: 2-(1-hydroxycyclopentyl)-2-phenyl-acetate; 2-hydroxyethyl(trimethyl)ammonium; hydroiodide Formula: C18H30INO4 MolecularWeight: 451.33957

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C1CCC(C1)(C(C2=CC=CC=C2)C(=O)[O-])O.I

Isomeric SMILES

C[N+](C)(C)CCO.C1CCC(C1)(C(C2=CC=CC=C2)C(=O)[O-])O.I

InChI

InChI=1S/C13H16O3.C5H14NO.HI/c14-12(15)11(10-6-2-1-3-7-10)13(16)8-4-5-9-13;1-6(2,3)4-5-7;/h1-3,6-7,11,16H,4-5,8-9H2,(H,14,15);7H,4-5H2,1-3H3;1H/q;+1;/p-1