(2S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(2,3-dihydro-p-dioxin-5-carbonylamino)-4-(methylthio)butyrate Formula: C10H14NO5S- MolecularWeight: 260.28686

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C1=COCCO1

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)C1=COCCO1

InChI

InChI=1S/C10H15NO5S/c1-17-5-2-7(10(13)14)11-9(12)8-6-15-3-4-16-8/h6-7H,2-5H2,1H3,(H,11,12)(H,13,14)/p-1/t7-/m0/s1