[2-(dimethylaminomethyl)-2-(phenylcarbonyloxy)butyl]-dimethyl-azanium chloride

Systemtic Name: [2-(dimethylaminomethyl)-2-(phenylcarbonyloxy)butyl]-dimethyl-azanium chloride Openeye Name: [2-benzoyloxy-2-(dimethylaminomethyl)butyl]-dimethyl-ammonium chloride CAS Name: [2-benzoyloxy-2-(dimethylaminomethyl)butyl]-dimethylammonium chloride IUPAC Name: [2-benzoyloxy-2-(dimethylaminomethyl)butyl]-dimethylazanium chloride Traditional Name: [2-benzoyloxy-2-(dimethylaminomethyl)butyl]-dimethyl-ammonium chloride Formula: C16H27ClN2O2 MolecularWeight: 314.85078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2.ClH/c1-6-16(12-17(2)3,13-18(4)5)20-15(19)14-10-8-7-9-11-14;/h7-11H,6,12-13H2,1-5H3;1H