3-(4-butoxy-3-methyl-phenyl)carbonyloxypropyl-dimethyl-azanium chloride

Systemtic Name: 3-(4-butoxy-3-methyl-phenyl)carbonyloxypropyl-dimethyl-azanium chloride Openeye Name: 3-(4-butoxy-3-methyl-benzoyl)oxypropyl-dimethyl-ammonium chloride CAS Name: 3-[(4-butoxy-3-methylphenyl)-oxomethoxy]propyl-dimethylammonium chloride IUPAC Name: 3-(4-butoxy-3-methylbenzoyl)oxypropyl-dimethylazanium chloride Traditional Name: 3-(4-butoxy-3-methyl-benzoyl)oxypropyl-dimethyl-ammonium chloride Formula: C17H28ClNO3 MolecularWeight: 329.86212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCCC[NH+](C)C)C.[Cl-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCCC[NH+](C)C)C.[Cl-]

InChI

InChI=1S/C17H27NO3.ClH/c1-5-6-11-20-16-9-8-15(13-14(16)2)17(19)21-12-7-10-18(3)4;/h8-9,13H,5-7,10-12H2,1-4H3;1H