2-[2-(5-methyl-3-oxidanylidene-1,2-oxazol-2-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-(5-methyl-3-oxidanylidene-1,2-oxazol-2-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(5-methyl-3-oxo-isoxazol-2-yl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(5-methyl-3-oxo-2-isoxazolyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(5-methyl-3-oxo-1,2-oxazol-2-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-keto-2-(3-keto-5-methyl-4-isoxazolin-2-yl)ethyl]thio]propionic acid Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(O1)C(=O)CSC(C)C(=O)O

Isomeric SMILES

CC1=CC(=O)N(O1)C(=O)CSC(C)C(=O)O

InChI

InChI=1S/C9H11NO5S/c1-5-3-7(11)10(15-5)8(12)4-16-6(2)9(13)14/h3,6H,4H2,1-2H3,(H,13,14)