[(2S)-1-ethoxy-1-oxidanylidene-3-(2-phenylethanoylsulfanyl)propan-2-yl]azanium

Systemtic Name: [(2S)-1-ethoxy-1-oxidanylidene-3-(2-phenylethanoylsulfanyl)propan-2-yl]azanium Openeye Name: [(1S)-2-ethoxy-2-oxo-1-[(2-phenylacetyl)sulfanylmethyl]ethyl]ammonium CAS Name: [(2S)-1-ethoxy-1-oxo-3-[(1-oxo-2-phenylethyl)thio]propan-2-yl]ammonium IUPAC Name: [(2S)-1-ethoxy-1-oxo-3-(2-phenylacetyl)sulfanylpropan-2-yl]azanium Traditional Name: [(1S)-2-ethoxy-2-keto-1-[[(2-phenylacetyl)thio]methyl]ethyl]ammonium Formula: C13H18NO3S+ MolecularWeight: 268.35192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC(=O)CC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CCOC(=O)[C@@H](CSC(=O)CC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C13H17NO3S/c1-2-17-13(16)11(14)9-18-12(15)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9,14H2,1H3/p+1/t11-/m1/s1