trimethyl-[(2S)-1-oxidanyl-1-phenyl-propan-2-yl]azanium bromide

Systemtic Name: trimethyl-[(2S)-1-oxidanyl-1-phenyl-propan-2-yl]azanium bromide Openeye Name: [(1S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-trimethyl-ammonium bromide CAS Name: [(2S)-1-hydroxy-1-phenylpropan-2-yl]-trimethylammonium bromide IUPAC Name: [(2S)-1-hydroxy-1-phenylpropan-2-yl]-trimethylazanium bromide Traditional Name: [(1S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-trimethyl-ammonium bromide Formula: C12H20BrNO MolecularWeight: 274.1973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[N+](C)(C)C.[Br-]

Isomeric SMILES

C[C@@H](C(C1=CC=CC=C1)O)[N+](C)(C)C.[Br-]

InChI

InChI=1S/C12H20NO.BrH/c1-10(13(2,3)4)12(14)11-8-6-5-7-9-11;/h5-10,12,14H,1-4H3;1H/q+1;/p-1/t10-,12?;/m0./s1