dimethyl-[3-[2-(phenylmethylsulfanyl)phenyl]carbonyloxypropyl]azanium chloride

Systemtic Name: dimethyl-[3-[2-(phenylmethylsulfanyl)phenyl]carbonyloxypropyl]azanium chloride Openeye Name: 3-(2-benzylsulfanylbenzoyl)oxypropyl-dimethyl-ammonium chloride CAS Name: dimethyl-[3-[oxo-[2-(phenylmethylthio)phenyl]methoxy]propyl]ammonium chloride IUPAC Name: 3-(2-benzylsulfanylbenzoyl)oxypropyl-dimethylazanium chloride Traditional Name: 3-[2-(benzylthio)benzoyl]oxypropyl-dimethyl-ammonium chloride Formula: C19H24ClNO2S MolecularWeight: 365.91736

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC(=O)C1=CC=CC=C1SCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[NH+](C)CCCOC(=O)C1=CC=CC=C1SCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C19H23NO2S.ClH/c1-20(2)13-8-14-22-19(21)17-11-6-7-12-18(17)23-15-16-9-4-3-5-10-16;/h3-7,9-12H,8,13-15H2,1-2H3;1H