2-[2-(2-methylpropanoyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride

Systemtic Name: 2-[2-(2-methylpropanoyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride Openeye Name: diisopropyl-[2-[2-(2-methylpropanoyl)phenoxy]ethyl]ammonium chloride CAS Name: 2-[2-(2-methyl-1-oxopropyl)phenoxy]ethyl-di(propan-2-yl)ammonium chloride IUPAC Name: 2-[2-(2-methylpropanoyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride Traditional Name: 2-(2-isobutyrylphenoxy)ethyl-diisopropyl-ammonium chloride Formula: C18H30ClNO2 MolecularWeight: 327.8893

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC=CC=C1OCC[NH+](C(C)C)C(C)C.[Cl-]

Isomeric SMILES

CC(C)C(=O)C1=CC=CC=C1OCC[NH+](C(C)C)C(C)C.[Cl-]

InChI

InChI=1S/C18H29NO2.ClH/c1-13(2)18(20)16-9-7-8-10-17(16)21-12-11-19(14(3)4)15(5)6;/h7-10,13-15H,11-12H2,1-6H3;1H