[(2R)-2-acetyloxy-4-oxidanylidene-4-phenylmethoxy-butyl]-trimethyl-azanium chloride

Systemtic Name: [(2R)-2-acetyloxy-4-oxidanylidene-4-phenylmethoxy-butyl]-trimethyl-azanium chloride Openeye Name: [(2R)-2-acetoxy-4-benzyloxy-4-oxo-butyl]-trimethyl-ammonium chloride CAS Name: [(2R)-2-acetyloxy-4-oxo-4-phenylmethoxybutyl]-trimethylammonium chloride IUPAC Name: [(2R)-2-acetyloxy-4-oxo-4-phenylmethoxybutyl]-trimethylazanium chloride Traditional Name: [(2R)-2-acetoxy-4-benzoxy-4-keto-butyl]-trimethyl-ammonium chloride Formula: C16H24ClNO4 MolecularWeight: 329.81906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C.[Cl-]

Isomeric SMILES

CC(=O)O[C@H](CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C16H24NO4.ClH/c1-13(18)21-15(11-17(2,3)4)10-16(19)20-12-14-8-6-5-7-9-14;/h5-9,15H,10-12H2,1-4H3;1H/q+1;/p-1/t15-;/m1./s1