3-(2-bromophenyl)carbonyloxypropyl-dimethyl-azanium chloride

Systemtic Name: 3-(2-bromophenyl)carbonyloxypropyl-dimethyl-azanium chloride Openeye Name: 3-(2-bromobenzoyl)oxypropyl-dimethyl-ammonium chloride CAS Name: 3-[(2-bromophenyl)-oxomethoxy]propyl-dimethylammonium chloride IUPAC Name: 3-(2-bromobenzoyl)oxypropyl-dimethylazanium chloride Traditional Name: 3-(2-bromobenzoyl)oxypropyl-dimethyl-ammonium chloride Formula: C12H17BrClNO2 MolecularWeight: 322.62588

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC(=O)C1=CC=CC=C1Br.[Cl-]

Isomeric SMILES

C[NH+](C)CCCOC(=O)C1=CC=CC=C1Br.[Cl-]

InChI

InChI=1S/C12H16BrNO2.ClH/c1-14(2)8-5-9-16-12(15)10-6-3-4-7-11(10)13;/h3-4,6-7H,5,8-9H2,1-2H3;1H