[3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-dimethyl-propan-2-yl-azanium iodide

Systemtic Name: [3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-dimethyl-propan-2-yl-azanium iodide Openeye Name: [3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-isopropyl-dimethyl-ammonium iodide CAS Name: [3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-dimethyl-propan-2-ylammonium iodide IUPAC Name: [3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-dimethyl-propan-2-ylazanium iodide Traditional Name: [3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-isopropyl-dimethyl-ammonium iodide Formula: C16H28INO2 MolecularWeight: 393.30349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(C[N+](C)(C)C(C)C)O.[I-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(C[N+](C)(C)C(C)C)O.[I-]

InChI

InChI=1S/C16H28NO2.HI/c1-12(2)17(5,6)10-15(18)11-19-16-13(3)8-7-9-14(16)4;/h7-9,12,15,18H,10-11H2,1-6H3;1H/q+1;/p-1