diethyl-(2-hydroxyethyl)-methyl-azanium; 2-phenylpentanoate; hydroiodide

Systemtic Name: diethyl-(2-hydroxyethyl)-methyl-azanium; 2-phenylpentanoate; hydroiodide Openeye Name: diethyl-(2-hydroxyethyl)-methyl-ammonium; 2-phenylpentanoate; hydroiodide CAS Name: diethyl-(2-hydroxyethyl)-methylammonium; 2-phenylpentanoate; hydroiodide IUPAC Name: diethyl-(2-hydroxyethyl)-methylazanium; 2-phenylpentanoate; hydroiodide Traditional Name: diethyl-(2-hydroxyethyl)-methyl-ammonium; 2-phenylvalerate; hydroiodide Formula: C18H32INO3 MolecularWeight: 437.35605

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2.C7H18NO.HI/c1-2-6-10(11(12)13)9-7-4-3-5-8-9;1-4-8(3,5-2)6-7-9;/h3-5,7-8,10H,2,6H2,1H3,(H,12,13);9H,4-7H2,1-3H3;1H/q;+1;/p-1