(2-cyano-2-methylsulfinyl-ethanoyl) (4E)-4-(2-cyano-2-methylsulfinyl-ethanoyl)oxy-4-hydroxyimino-butanoate

Systemtic Name: (2-cyano-2-methylsulfinyl-ethanoyl) (4E)-4-(2-cyano-2-methylsulfinyl-ethanoyl)oxy-4-hydroxyimino-butanoate Openeye Name: (2-cyano-2-methylsulfinyl-acetyl) (4E)-4-(2-cyano-2-methylsulfinyl-acetyl)oxy-4-hydroxyimino-butanoate CAS Name: (4E)-4-(2-cyano-2-methylsulfinyl-1-oxoethoxy)-4-hydroxyiminobutanoic acid (2-cyano-2-methylsulfinyl-1-oxoethyl) ester IUPAC Name: (2-cyano-2-methylsulfinylacetyl) (4E)-4-(2-cyano-2-methylsulfinylacetyl)oxy-4-hydroxyiminobutanoate Traditional Name: (4E)-4-(2-cyano-2-methylsulfinyl-acetyl)oxy-4-hydroximino-butyric acid (2-cyano-2-methylsulfinyl-acetyl) ester Formula: C12H13N3O8S2 MolecularWeight: 391.37692

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C(C#N)C(=O)OC(=NO)CCC(=O)OC(=O)C(C#N)S(=O)C

Isomeric SMILES

CS(=O)C(C#N)C(=O)O/C(=N/O)/CCC(=O)OC(=O)C(C#N)S(=O)C

InChI

InChI=1S/C12H13N3O8S2/c1-24(20)7(5-13)11(17)22-9(15-19)3-4-10(16)23-12(18)8(6-14)25(2)21/h7-8,19H,3-4H2,1-2H3/b15-9+