2-(3-bromophenyl)carbonyloxyethyl-tert-butyl-methyl-azanium chloride

Systemtic Name: 2-(3-bromophenyl)carbonyloxyethyl-tert-butyl-methyl-azanium chloride Openeye Name: 2-(3-bromobenzoyl)oxyethyl-tert-butyl-methyl-ammonium chloride CAS Name: 2-[(3-bromophenyl)-oxomethoxy]ethyl-tert-butyl-methylammonium chloride IUPAC Name: 2-(3-bromobenzoyl)oxyethyl-tert-butyl-methylazanium chloride Traditional Name: 2-(3-bromobenzoyl)oxyethyl-tert-butyl-methyl-ammonium chloride Formula: C14H21BrClNO2 MolecularWeight: 350.67904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrNO2.ClH/c1-14(2,3)16(4)8-9-18-13(17)11-6-5-7-12(15)10-11;/h5-7,10H,8-9H2,1-4H3;1H