2-(1-oxidanylidene-1-phenyl-butan-2-yl)oxyethyl-di(propan-2-yl)azanium chloride

Systemtic Name: 2-(1-oxidanylidene-1-phenyl-butan-2-yl)oxyethyl-di(propan-2-yl)azanium chloride Openeye Name: 2-(1-benzoylpropoxy)ethyl-diisopropyl-ammonium chloride CAS Name: 2-(1-oxo-1-phenylbutan-2-yl)oxyethyl-di(propan-2-yl)ammonium chloride IUPAC Name: 2-(1-oxo-1-phenylbutan-2-yl)oxyethyl-di(propan-2-yl)azanium chloride Traditional Name: 2-(1-benzoylpropoxy)ethyl-diisopropyl-ammonium chloride Formula: C18H30ClNO2 MolecularWeight: 327.8893

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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