[(2S)-1-methoxy-3-[(4-methoxyphenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]azanium chloride

Systemtic Name: [(2S)-1-methoxy-3-[(4-methoxyphenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]azanium chloride Openeye Name: [(1S)-2-methoxy-1-[(4-methoxyphenyl)methylsulfanylmethyl]-2-oxo-ethyl]ammonium chloride CAS Name: [(2S)-1-methoxy-3-[(4-methoxyphenyl)methylthio]-1-oxopropan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-methoxy-3-[(4-methoxyphenyl)methylsulfanyl]-1-oxopropan-2-yl]azanium chloride Traditional Name: [(1S)-2-keto-2-methoxy-1-[(p-anisylthio)methyl]ethyl]ammonium chloride Formula: C12H18ClNO3S MolecularWeight: 291.79422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSCC(C(=O)OC)[NH3+].[Cl-]

Isomeric SMILES

COC1=CC=C(C=C1)CSC[C@H](C(=O)OC)[NH3+].[Cl-]

InChI

InChI=1S/C12H17NO3S.ClH/c1-15-10-5-3-9(4-6-10)7-17-8-11(13)12(14)16-2;/h3-6,11H,7-8,13H2,1-2H3;1H/t11-;/m1./s1