dimethyl-[2-[2-(phenylmethylsulfanyl)phenyl]carbonyloxyethyl]azanium chloride

Systemtic Name: dimethyl-[2-[2-(phenylmethylsulfanyl)phenyl]carbonyloxyethyl]azanium chloride Openeye Name: 2-(2-benzylsulfanylbenzoyl)oxyethyl-dimethyl-ammonium chloride CAS Name: dimethyl-[2-[oxo-[2-(phenylmethylthio)phenyl]methoxy]ethyl]ammonium chloride IUPAC Name: 2-(2-benzylsulfanylbenzoyl)oxyethyl-dimethylazanium chloride Traditional Name: 2-[2-(benzylthio)benzoyl]oxyethyl-dimethyl-ammonium chloride Formula: C18H22ClNO2S MolecularWeight: 351.89078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO2S.ClH/c1-19(2)12-13-21-18(20)16-10-6-7-11-17(16)22-14-15-8-4-3-5-9-15;/h3-11H,12-14H2,1-2H3;1H