methyl 2-[6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-pyridin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-pyridin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[[6-(2-methoxy-2-oxo-ethyl)sulfanyl-5-nitro-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[6-[(2-methoxy-2-oxoethyl)thio]-5-nitro-2-pyridinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-(2-methoxy-2-oxoethyl)sulfanyl-5-nitropyridin-2-yl]sulfanylacetate Traditional Name: 2-[[6-[(2-keto-2-methoxy-ethyl)thio]-5-nitro-2-pyridyl]thio]acetic acid methyl ester Formula: C11H12N2O6S2 MolecularWeight: 332.35278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=C(C=C1)[N+](=O)[O-])SCC(=O)OC

Isomeric SMILES

COC(=O)CSC1=NC(=C(C=C1)[N+](=O)[O-])SCC(=O)OC

InChI

InChI=1S/C11H12N2O6S2/c1-18-9(14)5-20-8-4-3-7(13(16)17)11(12-8)21-6-10(15)19-2/h3-4H,5-6H2,1-2H3